Found 84 hits of Enzyme Inhibition Constant Data Target/Host
(Institution) | Ligand | Target/Host
Links | Ligand
Links | Trg + Lig
Links | Ki
nM | ΔG°
kJ/mole | IC50
nM | Kd
nM | EC50/IC50
nM | koff
s-1 | kon
M-1s-1 | pH | Temp
°C |
|---|
Melanin-concentrating hormone receptor 1
(RAT) | BDBM50107746
(CHEMBL3600828)Show SMILES Clc1ccc(cc1)-c1ccc(nc1)C#Cc1ccc(OCCN2CCCC2)cc1 Show InChI InChI=1S/C25H23ClN2O/c26-23-9-6-21(7-10-23)22-8-12-24(27-19-22)11-3-20-4-13-25(14-5-20)29-18-17-28-15-1-2-16-28/h4-10,12-14,19H,1-2,15-18H2 | Reactome pathway
KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet 
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Boehringer Ingelheim Pharma GmbH& Co. KG
Curated by ChEMBL
| Assay Description
Antagonist activity against rat MCHR1 |
Bioorg Med Chem Lett 25: 3264-9 (2015)
Article DOI: 10.1016/j.bmcl.2015.05.077
BindingDB Entry DOI: 10.7270/Q25D8TMB |
More data for this
Ligand-Target Pair | |
Melanin-concentrating hormone receptor 1
(Homo sapiens (Human)) | BDBM50107817
(CHEMBL3600810)Show SMILES Fc1cc(ccc1C(=O)NCCc1ccc(CN2CCCC2)cc1)-c1ccc(Cl)cc1 Show InChI InChI=1S/C26H26ClFN2O/c27-23-10-7-21(8-11-23)22-9-12-24(25(28)17-22)26(31)29-14-13-19-3-5-20(6-4-19)18-30-15-1-2-16-30/h3-12,17H,1-2,13-16,18H2,(H,29,31) | Reactome pathway
KEGG
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 1 | n/a | n/a | n/a | n/a | n/a | n/a |
Boehringer Ingelheim Pharma GmbH& Co. KG
Curated by ChEMBL
| Assay Description
Displacement of [125I]-MCH from human MCHR1 expressed in CHO/Galpha16 cell membranes by scintillation counting method |
Bioorg Med Chem Lett 25: 3264-9 (2015)
Article DOI: 10.1016/j.bmcl.2015.05.077
BindingDB Entry DOI: 10.7270/Q25D8TMB |
More data for this
Ligand-Target Pair | |
Melanin-concentrating hormone receptor 1
(Homo sapiens (Human)) | BDBM50107818
(CHEMBL3600811)Show SMILES Fc1cc(ccc1-c1ccc(Cl)cc1)C(=O)NCCc1ccc(CN2CCCC2)cc1 Show InChI InChI=1S/C26H26ClFN2O/c27-23-10-7-21(8-11-23)24-12-9-22(17-25(24)28)26(31)29-14-13-19-3-5-20(6-4-19)18-30-15-1-2-16-30/h3-12,17H,1-2,13-16,18H2,(H,29,31) | Reactome pathway
KEGG
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 1 | n/a | n/a | n/a | n/a | n/a | n/a |
Boehringer Ingelheim Pharma GmbH& Co. KG
Curated by ChEMBL
| Assay Description
Displacement of [125I]-MCH from human MCHR1 expressed in CHO/Galpha16 cell membranes by scintillation counting method |
Bioorg Med Chem Lett 25: 3264-9 (2015)
Article DOI: 10.1016/j.bmcl.2015.05.077
BindingDB Entry DOI: 10.7270/Q25D8TMB |
More data for this
Ligand-Target Pair | |
Melanin-concentrating hormone receptor 1
(Homo sapiens (Human)) | BDBM50107764
(CHEMBL3600807)Show SMILES Clc1ccc(cc1)-c1ccc(cc1)C(=O)NCCc1ccc(CN2CCCC2)cc1Br Show InChI InChI=1S/C26H26BrClN2O/c27-25-17-19(18-30-15-1-2-16-30)3-4-22(25)13-14-29-26(31)23-7-5-20(6-8-23)21-9-11-24(28)12-10-21/h3-12,17H,1-2,13-16,18H2,(H,29,31) | Reactome pathway
KEGG
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 2 | n/a | n/a | n/a | n/a | n/a | n/a |
Boehringer Ingelheim Pharma GmbH& Co. KG
Curated by ChEMBL
| Assay Description
Displacement of [125I]-MCH from human MCHR1 expressed in CHO/Galpha16 cell membranes by scintillation counting method |
Bioorg Med Chem Lett 25: 3264-9 (2015)
Article DOI: 10.1016/j.bmcl.2015.05.077
BindingDB Entry DOI: 10.7270/Q25D8TMB |
More data for this
Ligand-Target Pair | |
Melanin-concentrating hormone receptor 1
(Homo sapiens (Human)) | BDBM50107760
(CHEMBL3600803)Show SMILES Clc1ccc(cc1)-c1ccc(cc1)C(=O)NCCc1ccc(CN2CCCCC2)cc1 Show InChI InChI=1S/C27H29ClN2O/c28-26-14-12-24(13-15-26)23-8-10-25(11-9-23)27(31)29-17-16-21-4-6-22(7-5-21)20-30-18-2-1-3-19-30/h4-15H,1-3,16-20H2,(H,29,31) | Reactome pathway
KEGG
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 2 | n/a | n/a | n/a | n/a | n/a | n/a |
Boehringer Ingelheim Pharma GmbH& Co. KG
Curated by ChEMBL
| Assay Description
Displacement of [125I]-MCH from human MCHR1 expressed in CHO/Galpha16 cell membranes by scintillation counting method |
Bioorg Med Chem Lett 25: 3264-9 (2015)
Article DOI: 10.1016/j.bmcl.2015.05.077
BindingDB Entry DOI: 10.7270/Q25D8TMB |
More data for this
Ligand-Target Pair | |
Melanin-concentrating hormone receptor 1
(Homo sapiens (Human)) | BDBM50107761
(CHEMBL3600804)Show SMILES OCCNCc1ccc(CCNC(=O)c2ccc(cc2)-c2ccc(Cl)cc2)cc1 Show InChI InChI=1S/C24H25ClN2O2/c25-23-11-9-21(10-12-23)20-5-7-22(8-6-20)24(29)27-14-13-18-1-3-19(4-2-18)17-26-15-16-28/h1-12,26,28H,13-17H2,(H,27,29) | Reactome pathway
KEGG
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 2 | n/a | n/a | n/a | n/a | n/a | n/a |
Boehringer Ingelheim Pharma GmbH& Co. KG
Curated by ChEMBL
| Assay Description
Displacement of [125I]-MCH from human MCHR1 expressed in CHO/Galpha16 cell membranes by scintillation counting method |
Bioorg Med Chem Lett 25: 3264-9 (2015)
Article DOI: 10.1016/j.bmcl.2015.05.077
BindingDB Entry DOI: 10.7270/Q25D8TMB |
More data for this
Ligand-Target Pair | |
Melanin-concentrating hormone receptor 1
(Homo sapiens (Human)) | BDBM50107733
(CHEMBL3600801)Show SMILES Clc1ccc(cc1)-c1ccc(cc1)C(=O)NCCc1ccc(CN2CCCC2)cc1 Show InChI InChI=1S/C26H27ClN2O/c27-25-13-11-23(12-14-25)22-7-9-24(10-8-22)26(30)28-16-15-20-3-5-21(6-4-20)19-29-17-1-2-18-29/h3-14H,1-2,15-19H2,(H,28,30) | Reactome pathway
KEGG
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 2 | n/a | n/a | n/a | n/a | n/a | n/a |
Boehringer Ingelheim Pharma GmbH& Co. KG
Curated by ChEMBL
| Assay Description
Displacement of [125I]-MCH from human MCHR1 expressed in CHO/Galpha16 cell membranes by scintillation counting method |
Bioorg Med Chem Lett 25: 3264-9 (2015)
Article DOI: 10.1016/j.bmcl.2015.05.077
BindingDB Entry DOI: 10.7270/Q25D8TMB |
More data for this
Ligand-Target Pair | |
Melanin-concentrating hormone receptor 1
(Homo sapiens (Human)) | BDBM50107820
(CHEMBL3600812)Show SMILES Fc1ccc(cc1)-c1ccc(cc1)C(=O)NCCc1ccc(CN2CCCC2)cc1 Show InChI InChI=1S/C26H27FN2O/c27-25-13-11-23(12-14-25)22-7-9-24(10-8-22)26(30)28-16-15-20-3-5-21(6-4-20)19-29-17-1-2-18-29/h3-14H,1-2,15-19H2,(H,28,30) | Reactome pathway
KEGG
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 3 | n/a | n/a | n/a | n/a | n/a | n/a |
Boehringer Ingelheim Pharma GmbH& Co. KG
Curated by ChEMBL
| Assay Description
Displacement of [125I]-MCH from human MCHR1 expressed in CHO/Galpha16 cell membranes by scintillation counting method |
Bioorg Med Chem Lett 25: 3264-9 (2015)
Article DOI: 10.1016/j.bmcl.2015.05.077
BindingDB Entry DOI: 10.7270/Q25D8TMB |
More data for this
Ligand-Target Pair | |
Melanin-concentrating hormone receptor 1
(Homo sapiens (Human)) | BDBM50107735
(CHEMBL3600815)Show SMILES CC(=O)NC1CCN(Cc2ccc(CCNC(=O)c3ccc(cc3)-c3ccc(F)cc3)cc2)CC1 Show InChI InChI=1S/C29H32FN3O2/c1-21(34)32-28-15-18-33(19-16-28)20-23-4-2-22(3-5-23)14-17-31-29(35)26-8-6-24(7-9-26)25-10-12-27(30)13-11-25/h2-13,28H,14-20H2,1H3,(H,31,35)(H,32,34) | Reactome pathway
KEGG
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 3 | n/a | n/a | n/a | n/a | n/a | n/a |
Boehringer Ingelheim Pharma GmbH& Co. KG
Curated by ChEMBL
| Assay Description
Displacement of [125I]-MCH from human MCHR1 expressed in CHO/Galpha16 cell membranes by scintillation counting method |
Bioorg Med Chem Lett 25: 3264-9 (2015)
Article DOI: 10.1016/j.bmcl.2015.05.077
BindingDB Entry DOI: 10.7270/Q25D8TMB |
More data for this
Ligand-Target Pair | |
Melanin-concentrating hormone receptor 1
(Homo sapiens (Human)) | BDBM50107751
(CHEMBL3601023)Show SMILES Cc1cc(ccc1OCCN1CCC[C@H]1CO)C#Cc1ccc(cn1)-c1ccc(Cl)cc1 |r| Show InChI InChI=1S/C27H27ClN2O2/c1-20-17-21(5-13-27(20)32-16-15-30-14-2-3-26(30)19-31)4-11-25-12-8-23(18-29-25)22-6-9-24(28)10-7-22/h5-10,12-13,17-18,26,31H,2-3,14-16,19H2,1H3/t26-/m0/s1 | Reactome pathway
KEGG
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 4 | n/a | n/a | n/a | n/a | n/a | n/a |
Boehringer Ingelheim Pharma GmbH& Co. KG
Curated by ChEMBL
| Assay Description
Displacement of [125I]-MCH from human MCHR1 expressed in CHO/Galpha16 cell membranes by scintillation counting method |
Bioorg Med Chem Lett 25: 3264-9 (2015)
Article DOI: 10.1016/j.bmcl.2015.05.077
BindingDB Entry DOI: 10.7270/Q25D8TMB |
More data for this
Ligand-Target Pair | |
Melanin-concentrating hormone receptor 1
(Homo sapiens (Human)) | BDBM50107749
(CHEMBL3601021)Show SMILES CC1CCN(CCOc2ccc(cc2)C#Cc2ncc(cc2F)-c2ccc(Cl)cc2)CC1 Show InChI InChI=1S/C27H26ClFN2O/c1-20-12-14-31(15-13-20)16-17-32-25-9-2-21(3-10-25)4-11-27-26(29)18-23(19-30-27)22-5-7-24(28)8-6-22/h2-3,5-10,18-20H,12-17H2,1H3 | Reactome pathway
KEGG
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 4 | n/a | n/a | n/a | n/a | n/a | n/a |
Boehringer Ingelheim Pharma GmbH& Co. KG
Curated by ChEMBL
| Assay Description
Displacement of [125I]-MCH from human MCHR1 expressed in CHO/Galpha16 cell membranes by scintillation counting method |
Bioorg Med Chem Lett 25: 3264-9 (2015)
Article DOI: 10.1016/j.bmcl.2015.05.077
BindingDB Entry DOI: 10.7270/Q25D8TMB |
More data for this
Ligand-Target Pair | |
Melanin-concentrating hormone receptor 1
(Homo sapiens (Human)) | BDBM50107747
(CHEMBL3600830)Show SMILES CC1CCN(CCOc2ccc(cc2)C#Cc2ccc(cn2)-c2ccc(Cl)cc2)CC1 Show InChI InChI=1S/C27H27ClN2O/c1-21-14-16-30(17-15-21)18-19-31-27-12-3-22(4-13-27)2-10-26-11-7-24(20-29-26)23-5-8-25(28)9-6-23/h3-9,11-13,20-21H,14-19H2,1H3 | Reactome pathway
KEGG
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 5 | n/a | n/a | n/a | n/a | n/a | n/a |
Boehringer Ingelheim Pharma GmbH& Co. KG
Curated by ChEMBL
| Assay Description
Displacement of [125I]-MCH from human MCHR1 expressed in CHO/Galpha16 cell membranes by scintillation counting method |
Bioorg Med Chem Lett 25: 3264-9 (2015)
Article DOI: 10.1016/j.bmcl.2015.05.077
BindingDB Entry DOI: 10.7270/Q25D8TMB |
More data for this
Ligand-Target Pair | |
Melanin-concentrating hormone receptor 1
(Homo sapiens (Human)) | BDBM50107737
(CHEMBL3600817)Show SMILES CC(=O)CNC1CCN(Cc2ccc(CCNC(=O)c3ccc(cc3)-c3ccc(F)cc3)cc2)CC1 Show InChI InChI=1S/C30H34FN3O2/c1-22(35)20-33-29-15-18-34(19-16-29)21-24-4-2-23(3-5-24)14-17-32-30(36)27-8-6-25(7-9-27)26-10-12-28(31)13-11-26/h2-13,29,33H,14-21H2,1H3,(H,32,36) | Reactome pathway
KEGG
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 5 | n/a | n/a | n/a | n/a | n/a | n/a |
Boehringer Ingelheim Pharma GmbH& Co. KG
Curated by ChEMBL
| Assay Description
Displacement of [125I]-MCH from human MCHR1 expressed in CHO/Galpha16 cell membranes by scintillation counting method |
Bioorg Med Chem Lett 25: 3264-9 (2015)
Article DOI: 10.1016/j.bmcl.2015.05.077
BindingDB Entry DOI: 10.7270/Q25D8TMB |
More data for this
Ligand-Target Pair | |
Melanin-concentrating hormone receptor 1
(Homo sapiens (Human)) | BDBM50107754
(CHEMBL3601017)Show SMILES Clc1ccc(cc1)-c1ccc(nc1)C#Cc1ccc(OCCN2CCCC2)c(Cl)c1 Show InChI InChI=1S/C25H22Cl2N2O/c26-22-8-5-20(6-9-22)21-7-11-23(28-18-21)10-3-19-4-12-25(24(27)17-19)30-16-15-29-13-1-2-14-29/h4-9,11-12,17-18H,1-2,13-16H2 | Reactome pathway
KEGG
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 5 | n/a | n/a | n/a | n/a | n/a | n/a |
Boehringer Ingelheim Pharma GmbH& Co. KG
Curated by ChEMBL
| Assay Description
Displacement of [125I]-MCH from human MCHR1 expressed in CHO/Galpha16 cell membranes by scintillation counting method |
Bioorg Med Chem Lett 25: 3264-9 (2015)
Article DOI: 10.1016/j.bmcl.2015.05.077
BindingDB Entry DOI: 10.7270/Q25D8TMB |
More data for this
Ligand-Target Pair | |
Melanin-concentrating hormone receptor 1
(Homo sapiens (Human)) | BDBM50107835
(CHEMBL3601011)Show SMILES Clc1ccc(cc1)-c1ccc(nc1)C#Cc1ccc(NCCN2CCCC2)cc1 Show InChI InChI=1S/C25H24ClN3/c26-23-9-6-21(7-10-23)22-8-14-25(28-19-22)13-5-20-3-11-24(12-4-20)27-15-18-29-16-1-2-17-29/h3-4,6-12,14,19,27H,1-2,15-18H2 | Reactome pathway
KEGG
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 5 | n/a | n/a | n/a | n/a | n/a | n/a |
Boehringer Ingelheim Pharma GmbH& Co. KG
Curated by ChEMBL
| Assay Description
Displacement of [125I]-MCH from human MCHR1 expressed in CHO/Galpha16 cell membranes by scintillation counting method |
Bioorg Med Chem Lett 25: 3264-9 (2015)
Article DOI: 10.1016/j.bmcl.2015.05.077
BindingDB Entry DOI: 10.7270/Q25D8TMB |
More data for this
Ligand-Target Pair | |
Melanin-concentrating hormone receptor 1
(Homo sapiens (Human)) | BDBM50107837
(CHEMBL3601013)Show SMILES Clc1ccc(cc1)-c1ccc(nc1)C#Cc1ccc(OCCN2CCCC2)nc1 Show InChI InChI=1S/C24H22ClN3O/c25-22-8-5-20(6-9-22)21-7-11-23(26-18-21)10-3-19-4-12-24(27-17-19)29-16-15-28-13-1-2-14-28/h4-9,11-12,17-18H,1-2,13-16H2 | Reactome pathway
KEGG
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 6 | n/a | n/a | n/a | n/a | n/a | n/a |
Boehringer Ingelheim Pharma GmbH& Co. KG
Curated by ChEMBL
| Assay Description
Displacement of [125I]-MCH from human MCHR1 expressed in CHO/Galpha16 cell membranes by scintillation counting method |
Bioorg Med Chem Lett 25: 3264-9 (2015)
Article DOI: 10.1016/j.bmcl.2015.05.077
BindingDB Entry DOI: 10.7270/Q25D8TMB |
More data for this
Ligand-Target Pair | |
Melanin-concentrating hormone receptor 1
(Homo sapiens (Human)) | BDBM50107832
(CHEMBL3601009)Show SMILES OC1(CCN(CCOc2ccc(cc2)C#Cc2ccc(cn2)-c2ccc(Cl)cc2)CC1)C(F)(F)F Show InChI InChI=1S/C27H24ClF3N2O2/c28-23-7-4-21(5-8-23)22-6-10-24(32-19-22)9-1-20-2-11-25(12-3-20)35-18-17-33-15-13-26(34,14-16-33)27(29,30)31/h2-8,10-12,19,34H,13-18H2 | Reactome pathway
KEGG
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 6 | n/a | n/a | n/a | n/a | n/a | n/a |
Boehringer Ingelheim Pharma GmbH& Co. KG
Curated by ChEMBL
| Assay Description
Displacement of [125I]-MCH from human MCHR1 expressed in CHO/Galpha16 cell membranes by scintillation counting method |
Bioorg Med Chem Lett 25: 3264-9 (2015)
Article DOI: 10.1016/j.bmcl.2015.05.077
BindingDB Entry DOI: 10.7270/Q25D8TMB |
More data for this
Ligand-Target Pair | |
Melanin-concentrating hormone receptor 1
(Homo sapiens (Human)) | BDBM50107734
(CHEMBL3600814)Show SMILES CC(=O)N1CCN(Cc2ccc(CCNC(=O)c3ccc(cc3)-c3ccc(Cl)cc3)cc2)CC1 Show InChI InChI=1S/C28H30ClN3O2/c1-21(33)32-18-16-31(17-19-32)20-23-4-2-22(3-5-23)14-15-30-28(34)26-8-6-24(7-9-26)25-10-12-27(29)13-11-25/h2-13H,14-20H2,1H3,(H,30,34) | Reactome pathway
KEGG
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 6 | n/a | n/a | n/a | n/a | n/a | n/a |
Boehringer Ingelheim Pharma GmbH& Co. KG
Curated by ChEMBL
| Assay Description
Displacement of [125I]-MCH from human MCHR1 expressed in CHO/Galpha16 cell membranes by scintillation counting method |
Bioorg Med Chem Lett 25: 3264-9 (2015)
Article DOI: 10.1016/j.bmcl.2015.05.077
BindingDB Entry DOI: 10.7270/Q25D8TMB |
More data for this
Ligand-Target Pair | |
Melanin-concentrating hormone receptor 1
(Homo sapiens (Human)) | BDBM50107763
(CHEMBL3600806)Show SMILES COc1cc(CCNC(=O)c2ccc(cc2)-c2ccc(Cl)cc2)ccc1CN1CCCC1 Show InChI InChI=1S/C27H29ClN2O2/c1-32-26-18-20(4-5-24(26)19-30-16-2-3-17-30)14-15-29-27(31)23-8-6-21(7-9-23)22-10-12-25(28)13-11-22/h4-13,18H,2-3,14-17,19H2,1H3,(H,29,31) | Reactome pathway
KEGG
UniProtKB/SwissProt
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GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 6 | n/a | n/a | n/a | n/a | n/a | n/a |
Boehringer Ingelheim Pharma GmbH& Co. KG
Curated by ChEMBL
| Assay Description
Displacement of [125I]-MCH from human MCHR1 expressed in CHO/Galpha16 cell membranes by scintillation counting method |
Bioorg Med Chem Lett 25: 3264-9 (2015)
Article DOI: 10.1016/j.bmcl.2015.05.077
BindingDB Entry DOI: 10.7270/Q25D8TMB |
More data for this
Ligand-Target Pair | |
Melanin-concentrating hormone receptor 1
(Homo sapiens (Human)) | BDBM50107831
(CHEMBL3600829)Show SMILES Brc1ccc(cc1)-c1ccc(nc1)C#Cc1ccc(OCCN2CCCC2)cc1 Show InChI InChI=1S/C25H23BrN2O/c26-23-9-6-21(7-10-23)22-8-12-24(27-19-22)11-3-20-4-13-25(14-5-20)29-18-17-28-15-1-2-16-28/h4-10,12-14,19H,1-2,15-18H2 | Reactome pathway
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| n/a | n/a | 6 | n/a | n/a | n/a | n/a | n/a | n/a |
Boehringer Ingelheim Pharma GmbH& Co. KG
Curated by ChEMBL
| Assay Description
Displacement of [125I]-MCH from human MCHR1 expressed in CHO/Galpha16 cell membranes by scintillation counting method |
Bioorg Med Chem Lett 25: 3264-9 (2015)
Article DOI: 10.1016/j.bmcl.2015.05.077
BindingDB Entry DOI: 10.7270/Q25D8TMB |
More data for this
Ligand-Target Pair | |
Melanin-concentrating hormone receptor 1
(Homo sapiens (Human)) | BDBM50107746
(CHEMBL3600828)Show SMILES Clc1ccc(cc1)-c1ccc(nc1)C#Cc1ccc(OCCN2CCCC2)cc1 Show InChI InChI=1S/C25H23ClN2O/c26-23-9-6-21(7-10-23)22-8-12-24(27-19-22)11-3-20-4-13-25(14-5-20)29-18-17-28-15-1-2-16-28/h4-10,12-14,19H,1-2,15-18H2 | Reactome pathway
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| n/a | n/a | 7 | n/a | n/a | n/a | n/a | n/a | n/a |
Boehringer Ingelheim Pharma GmbH& Co. KG
Curated by ChEMBL
| Assay Description
Displacement of [125I]-MCH from human MCHR1 expressed in CHO/Galpha16 cell membranes by scintillation counting method |
Bioorg Med Chem Lett 25: 3264-9 (2015)
Article DOI: 10.1016/j.bmcl.2015.05.077
BindingDB Entry DOI: 10.7270/Q25D8TMB |
More data for this
Ligand-Target Pair | |
Melanin-concentrating hormone receptor 1
(Homo sapiens (Human)) | BDBM50107762
(CHEMBL3600805)Show SMILES CCN(CC(=O)N(C)C)Cc1ccc(CCNC(=O)c2ccc(cc2)-c2ccc(Cl)cc2)cc1 Show InChI InChI=1S/C28H32ClN3O2/c1-4-32(20-27(33)31(2)3)19-22-7-5-21(6-8-22)17-18-30-28(34)25-11-9-23(10-12-25)24-13-15-26(29)16-14-24/h5-16H,4,17-20H2,1-3H3,(H,30,34) | Reactome pathway
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| n/a | n/a | 8 | n/a | n/a | n/a | n/a | n/a | n/a |
Boehringer Ingelheim Pharma GmbH& Co. KG
Curated by ChEMBL
| Assay Description
Displacement of [125I]-MCH from human MCHR1 expressed in CHO/Galpha16 cell membranes by scintillation counting method |
Bioorg Med Chem Lett 25: 3264-9 (2015)
Article DOI: 10.1016/j.bmcl.2015.05.077
BindingDB Entry DOI: 10.7270/Q25D8TMB |
More data for this
Ligand-Target Pair | |
Melanin-concentrating hormone receptor 1
(Homo sapiens (Human)) | BDBM50107816
(CHEMBL3600809)Show SMILES CN(CCc1ccc(CN2CCCC2)cc1)C(=O)c1ccc(cc1)-c1ccc(Cl)cc1 Show InChI InChI=1S/C27H29ClN2O/c1-29(19-16-21-4-6-22(7-5-21)20-30-17-2-3-18-30)27(31)25-10-8-23(9-11-25)24-12-14-26(28)15-13-24/h4-15H,2-3,16-20H2,1H3 | Reactome pathway
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| n/a | n/a | 8 | n/a | n/a | n/a | n/a | n/a | n/a |
Boehringer Ingelheim Pharma GmbH& Co. KG
Curated by ChEMBL
| Assay Description
Displacement of [125I]-MCH from human MCHR1 expressed in CHO/Galpha16 cell membranes by scintillation counting method |
Bioorg Med Chem Lett 25: 3264-9 (2015)
Article DOI: 10.1016/j.bmcl.2015.05.077
BindingDB Entry DOI: 10.7270/Q25D8TMB |
More data for this
Ligand-Target Pair | |
Melanin-concentrating hormone receptor 1
(Homo sapiens (Human)) | BDBM50107750
(CHEMBL3601022)Show SMILES OC[C@H]1CCCN1CCOc1ccc(cc1)C#Cc1ccc(cn1)-c1ccc(Cl)cc1 |r| Show InChI InChI=1S/C26H25ClN2O2/c27-23-9-6-21(7-10-23)22-8-12-24(28-18-22)11-3-20-4-13-26(14-5-20)31-17-16-29-15-1-2-25(29)19-30/h4-10,12-14,18,25,30H,1-2,15-17,19H2/t25-/m1/s1 | Reactome pathway
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| n/a | n/a | 8 | n/a | n/a | n/a | n/a | n/a | n/a |
Boehringer Ingelheim Pharma GmbH& Co. KG
Curated by ChEMBL
| Assay Description
Displacement of [125I]-MCH from human MCHR1 expressed in CHO/Galpha16 cell membranes by scintillation counting method |
Bioorg Med Chem Lett 25: 3264-9 (2015)
Article DOI: 10.1016/j.bmcl.2015.05.077
BindingDB Entry DOI: 10.7270/Q25D8TMB |
More data for this
Ligand-Target Pair | |
Melanin-concentrating hormone receptor 1
(Homo sapiens (Human)) | BDBM50107748
(CHEMBL3600831)Show SMILES NC(=O)C1CCN(CCOc2ccc(cc2)C#Cc2ccc(cn2)-c2ccc(Cl)cc2)CC1 Show InChI InChI=1S/C27H26ClN3O2/c28-24-7-4-21(5-8-24)23-6-10-25(30-19-23)9-1-20-2-11-26(12-3-20)33-18-17-31-15-13-22(14-16-31)27(29)32/h2-8,10-12,19,22H,13-18H2,(H2,29,32) | Reactome pathway
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| n/a | n/a | 8 | n/a | n/a | n/a | n/a | n/a | n/a |
Boehringer Ingelheim Pharma GmbH& Co. KG
Curated by ChEMBL
| Assay Description
Displacement of [125I]-MCH from human MCHR1 expressed in CHO/Galpha16 cell membranes by scintillation counting method |
Bioorg Med Chem Lett 25: 3264-9 (2015)
Article DOI: 10.1016/j.bmcl.2015.05.077
BindingDB Entry DOI: 10.7270/Q25D8TMB |
More data for this
Ligand-Target Pair | |
Melanin-concentrating hormone receptor 1
(Homo sapiens (Human)) | BDBM50107821
(CHEMBL3600813)Show SMILES Clc1ccc(c(Cl)c1)-c1ccc(cc1)C(=O)NCCc1ccc(CN2CCCC2)cc1 Show InChI InChI=1S/C26H26Cl2N2O/c27-23-11-12-24(25(28)17-23)21-7-9-22(10-8-21)26(31)29-14-13-19-3-5-20(6-4-19)18-30-15-1-2-16-30/h3-12,17H,1-2,13-16,18H2,(H,29,31) | Reactome pathway
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| n/a | n/a | 10 | n/a | n/a | n/a | n/a | n/a | n/a |
Boehringer Ingelheim Pharma GmbH& Co. KG
Curated by ChEMBL
| Assay Description
Displacement of [125I]-MCH from human MCHR1 expressed in CHO/Galpha16 cell membranes by scintillation counting method |
Bioorg Med Chem Lett 25: 3264-9 (2015)
Article DOI: 10.1016/j.bmcl.2015.05.077
BindingDB Entry DOI: 10.7270/Q25D8TMB |
More data for this
Ligand-Target Pair | |
Melanin-concentrating hormone receptor 1
(Homo sapiens (Human)) | BDBM50107833
(CHEMBL3600392)Show SMILES CN1CCN(CCOc2ccc(cc2)C#Cc2ccc(cn2)-c2ccc(Cl)cc2)CC1 Show InChI InChI=1S/C26H26ClN3O/c1-29-14-16-30(17-15-29)18-19-31-26-12-3-21(4-13-26)2-10-25-11-7-23(20-28-25)22-5-8-24(27)9-6-22/h3-9,11-13,20H,14-19H2,1H3 | Reactome pathway
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| n/a | n/a | 10 | n/a | n/a | n/a | n/a | n/a | n/a |
Boehringer Ingelheim Pharma GmbH& Co. KG
Curated by ChEMBL
| Assay Description
Displacement of [125I]-MCH from human MCHR1 expressed in CHO/Galpha16 cell membranes by scintillation counting method |
Bioorg Med Chem Lett 25: 3264-9 (2015)
Article DOI: 10.1016/j.bmcl.2015.05.077
BindingDB Entry DOI: 10.7270/Q25D8TMB |
More data for this
Ligand-Target Pair | |
Melanin-concentrating hormone receptor 1
(Homo sapiens (Human)) | BDBM50107838
(CHEMBL3601014)Show SMILES Clc1ccc(cc1)-c1ccc(nc1)C#Cc1ccc(OCCN2CCCC2)cn1 Show InChI InChI=1S/C24H22ClN3O/c25-21-6-3-19(4-7-21)20-5-8-22(26-17-20)9-10-23-11-12-24(18-27-23)29-16-15-28-13-1-2-14-28/h3-8,11-12,17-18H,1-2,13-16H2 | Reactome pathway
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| n/a | n/a | 10 | n/a | n/a | n/a | n/a | n/a | n/a |
Boehringer Ingelheim Pharma GmbH& Co. KG
Curated by ChEMBL
| Assay Description
Displacement of [125I]-MCH from human MCHR1 expressed in CHO/Galpha16 cell membranes by scintillation counting method |
Bioorg Med Chem Lett 25: 3264-9 (2015)
Article DOI: 10.1016/j.bmcl.2015.05.077
BindingDB Entry DOI: 10.7270/Q25D8TMB |
More data for this
Ligand-Target Pair | |
Melanin-concentrating hormone receptor 1
(Homo sapiens (Human)) | BDBM50107736
(CHEMBL3600816)Show SMILES CN(CCc1ccc(CN2CCC(CC2)NC(C)=O)cc1)C(=O)c1ccc(cc1)-c1ccc(F)cc1 Show InChI InChI=1S/C30H34FN3O2/c1-22(35)32-29-16-19-34(20-17-29)21-24-5-3-23(4-6-24)15-18-33(2)30(36)27-9-7-25(8-10-27)26-11-13-28(31)14-12-26/h3-14,29H,15-21H2,1-2H3,(H,32,35) | Reactome pathway
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| n/a | n/a | 11 | n/a | n/a | n/a | n/a | n/a | n/a |
Boehringer Ingelheim Pharma GmbH& Co. KG
Curated by ChEMBL
| Assay Description
Displacement of [125I]-MCH from human MCHR1 expressed in CHO/Galpha16 cell membranes by scintillation counting method |
Bioorg Med Chem Lett 25: 3264-9 (2015)
Article DOI: 10.1016/j.bmcl.2015.05.077
BindingDB Entry DOI: 10.7270/Q25D8TMB |
More data for this
Ligand-Target Pair | |
Melanin-concentrating hormone receptor 1
(Homo sapiens (Human)) | BDBM50107834
(CHEMBL3601010)Show SMILES Clc1ccc(cc1)-c1ccc(nc1)C#Cc1ccc(CCCN2CCCC2)cc1 Show InChI InChI=1S/C26H25ClN2/c27-25-13-10-23(11-14-25)24-12-16-26(28-20-24)15-9-22-7-5-21(6-8-22)4-3-19-29-17-1-2-18-29/h5-8,10-14,16,20H,1-4,17-19H2 | Reactome pathway
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| n/a | n/a | 11 | n/a | n/a | n/a | n/a | n/a | n/a |
Boehringer Ingelheim Pharma GmbH& Co. KG
Curated by ChEMBL
| Assay Description
Displacement of [125I]-MCH from human MCHR1 expressed in CHO/Galpha16 cell membranes by scintillation counting method |
Bioorg Med Chem Lett 25: 3264-9 (2015)
Article DOI: 10.1016/j.bmcl.2015.05.077
BindingDB Entry DOI: 10.7270/Q25D8TMB |
More data for this
Ligand-Target Pair | |
Melanin-concentrating hormone receptor 1
(Homo sapiens (Human)) | BDBM50107756
(CHEMBL3601019)Show SMILES Clc1ccc(cc1)-c1ccc(nn1)C#Cc1ccc(OCCN2CCCC2)cc1 Show InChI InChI=1S/C24H22ClN3O/c25-21-8-6-20(7-9-21)24-14-11-22(26-27-24)10-3-19-4-12-23(13-5-19)29-18-17-28-15-1-2-16-28/h4-9,11-14H,1-2,15-18H2 | Reactome pathway
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| n/a | n/a | 12 | n/a | n/a | n/a | n/a | n/a | n/a |
Boehringer Ingelheim Pharma GmbH& Co. KG
Curated by ChEMBL
| Assay Description
Displacement of [125I]-MCH from human MCHR1 expressed in CHO/Galpha16 cell membranes by scintillation counting method |
Bioorg Med Chem Lett 25: 3264-9 (2015)
Article DOI: 10.1016/j.bmcl.2015.05.077
BindingDB Entry DOI: 10.7270/Q25D8TMB |
More data for this
Ligand-Target Pair | |
Melanin-concentrating hormone receptor 1
(Homo sapiens (Human)) | BDBM50107822
(CHEMBL3600819)Show SMILES CCN(CC)CCOc1ccc(cc1)N(C)C(=O)c1ccc(cc1)-c1ccc(OC)cc1 Show InChI InChI=1S/C27H32N2O3/c1-5-29(6-2)19-20-32-26-17-13-24(14-18-26)28(3)27(30)23-9-7-21(8-10-23)22-11-15-25(31-4)16-12-22/h7-18H,5-6,19-20H2,1-4H3 | Reactome pathway
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| n/a | n/a | 15 | n/a | n/a | n/a | n/a | n/a | n/a |
Boehringer Ingelheim Pharma GmbH& Co. KG
Curated by ChEMBL
| Assay Description
Displacement of [125I]-MCH from human MCHR1 expressed in CHO/Galpha16 cell membranes by scintillation counting method |
Bioorg Med Chem Lett 25: 3264-9 (2015)
Article DOI: 10.1016/j.bmcl.2015.05.077
BindingDB Entry DOI: 10.7270/Q25D8TMB |
More data for this
Ligand-Target Pair | |
Melanin-concentrating hormone receptor 1
(Homo sapiens (Human)) | BDBM50107757
(CHEMBL3601020)Show SMILES Clc1ccc(cc1)-c1cnc(cn1)C#Cc1ccc(OCCN2CCCC2)cc1 Show InChI InChI=1S/C24H22ClN3O/c25-21-8-6-20(7-9-21)24-18-26-22(17-27-24)10-3-19-4-11-23(12-5-19)29-16-15-28-13-1-2-14-28/h4-9,11-12,17-18H,1-2,13-16H2 | Reactome pathway
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| n/a | n/a | 17 | n/a | n/a | n/a | n/a | n/a | n/a |
Boehringer Ingelheim Pharma GmbH& Co. KG
Curated by ChEMBL
| Assay Description
Displacement of [125I]-MCH from human MCHR1 expressed in CHO/Galpha16 cell membranes by scintillation counting method |
Bioorg Med Chem Lett 25: 3264-9 (2015)
Article DOI: 10.1016/j.bmcl.2015.05.077
BindingDB Entry DOI: 10.7270/Q25D8TMB |
More data for this
Ligand-Target Pair | |
Melanin-concentrating hormone receptor 1
(Homo sapiens (Human)) | BDBM50107830
(CHEMBL3600827)Show SMILES COc1ccc(cc1)-c1ccc(nc1)C#Cc1ccc(OCCN2CCCC2)cc1 Show InChI InChI=1S/C26H26N2O2/c1-29-25-14-8-22(9-15-25)23-7-11-24(27-20-23)10-4-21-5-12-26(13-6-21)30-19-18-28-16-2-3-17-28/h5-9,11-15,20H,2-3,16-19H2,1H3 | Reactome pathway
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| n/a | n/a | 20 | n/a | n/a | n/a | n/a | n/a | n/a |
Boehringer Ingelheim Pharma GmbH& Co. KG
Curated by ChEMBL
| Assay Description
Displacement of [125I]-MCH from human MCHR1 expressed in CHO/Galpha16 cell membranes by scintillation counting method |
Bioorg Med Chem Lett 25: 3264-9 (2015)
Article DOI: 10.1016/j.bmcl.2015.05.077
BindingDB Entry DOI: 10.7270/Q25D8TMB |
More data for this
Ligand-Target Pair | |
Melanin-concentrating hormone receptor 1
(Homo sapiens (Human)) | BDBM50107753
(CHEMBL3601016)Show SMILES Clc1ccc(cc1)-c1ccc(nc1)C#Cc1ccc(OCCN2CCCC2)cc1Cl Show InChI InChI=1S/C25H22Cl2N2O/c26-22-8-3-19(4-9-22)21-6-11-23(28-18-21)10-5-20-7-12-24(17-25(20)27)30-16-15-29-13-1-2-14-29/h3-4,6-9,11-12,17-18H,1-2,13-16H2 | Reactome pathway
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| n/a | n/a | 20 | n/a | n/a | n/a | n/a | n/a | n/a |
Boehringer Ingelheim Pharma GmbH& Co. KG
Curated by ChEMBL
| Assay Description
Displacement of [125I]-MCH from human MCHR1 expressed in CHO/Galpha16 cell membranes by scintillation counting method |
Bioorg Med Chem Lett 25: 3264-9 (2015)
Article DOI: 10.1016/j.bmcl.2015.05.077
BindingDB Entry DOI: 10.7270/Q25D8TMB |
More data for this
Ligand-Target Pair | |
Melanin-concentrating hormone receptor 1
(Homo sapiens (Human)) | BDBM50107836
(CHEMBL3601012)Show SMILES Clc1ccc(cc1)-c1ccc(nc1)C#Cc1ccc(CCN2CCCC2)cc1 Show InChI InChI=1S/C25H23ClN2/c26-24-11-8-22(9-12-24)23-10-14-25(27-19-23)13-7-20-3-5-21(6-4-20)15-18-28-16-1-2-17-28/h3-6,8-12,14,19H,1-2,15-18H2 | Reactome pathway
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| n/a | n/a | 26 | n/a | n/a | n/a | n/a | n/a | n/a |
Boehringer Ingelheim Pharma GmbH& Co. KG
Curated by ChEMBL
| Assay Description
Displacement of [125I]-MCH from human MCHR1 expressed in CHO/Galpha16 cell membranes by scintillation counting method |
Bioorg Med Chem Lett 25: 3264-9 (2015)
Article DOI: 10.1016/j.bmcl.2015.05.077
BindingDB Entry DOI: 10.7270/Q25D8TMB |
More data for this
Ligand-Target Pair | |
Melanin-concentrating hormone receptor 1
(Homo sapiens (Human)) | BDBM50107819
(CHEMBL3600390)Show SMILES Clc1cccc(c1)-c1ccc(cc1)C(=O)NCCc1ccc(CN2CCCC2)cc1 Show InChI InChI=1S/C26H27ClN2O/c27-25-5-3-4-24(18-25)22-10-12-23(13-11-22)26(30)28-15-14-20-6-8-21(9-7-20)19-29-16-1-2-17-29/h3-13,18H,1-2,14-17,19H2,(H,28,30) | Reactome pathway
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| n/a | n/a | 29 | n/a | n/a | n/a | n/a | n/a | n/a |
Boehringer Ingelheim Pharma GmbH& Co. KG
Curated by ChEMBL
| Assay Description
Displacement of [125I]-MCH from human MCHR1 expressed in CHO/Galpha16 cell membranes by scintillation counting method |
Bioorg Med Chem Lett 25: 3264-9 (2015)
Article DOI: 10.1016/j.bmcl.2015.05.077
BindingDB Entry DOI: 10.7270/Q25D8TMB |
More data for this
Ligand-Target Pair | |
Melanin-concentrating hormone receptor 1
(Homo sapiens (Human)) | BDBM50107823
(CHEMBL3600820)Show SMILES CCN(CC)CCOc1ccc(NC(=O)c2ccc(cc2)-c2ccc(OC)cc2)cc1 Show InChI InChI=1S/C26H30N2O3/c1-4-28(5-2)18-19-31-25-16-12-23(13-17-25)27-26(29)22-8-6-20(7-9-22)21-10-14-24(30-3)15-11-21/h6-17H,4-5,18-19H2,1-3H3,(H,27,29) | Reactome pathway
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| n/a | n/a | 33 | n/a | n/a | n/a | n/a | n/a | n/a |
Boehringer Ingelheim Pharma GmbH& Co. KG
Curated by ChEMBL
| Assay Description
Displacement of [125I]-MCH from human MCHR1 expressed in CHO/Galpha16 cell membranes by scintillation counting method |
Bioorg Med Chem Lett 25: 3264-9 (2015)
Article DOI: 10.1016/j.bmcl.2015.05.077
BindingDB Entry DOI: 10.7270/Q25D8TMB |
More data for this
Ligand-Target Pair | |
Melanin-concentrating hormone receptor 1
(Homo sapiens (Human)) | BDBM50107827
(CHEMBL3600824)Show SMILES CCN(CC)CCOc1ccc(cc1)C#Cc1ccc(cn1)-c1ccc(OC)cc1 Show InChI InChI=1S/C26H28N2O2/c1-4-28(5-2)18-19-30-26-14-7-21(8-15-26)6-12-24-13-9-23(20-27-24)22-10-16-25(29-3)17-11-22/h7-11,13-17,20H,4-5,18-19H2,1-3H3 | Reactome pathway
KEGG
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 35 | n/a | n/a | n/a | n/a | n/a | n/a |
Boehringer Ingelheim Pharma GmbH& Co. KG
Curated by ChEMBL
| Assay Description
Displacement of [125I]-MCH from human MCHR1 expressed in CHO/Galpha16 cell membranes by scintillation counting method |
Bioorg Med Chem Lett 25: 3264-9 (2015)
Article DOI: 10.1016/j.bmcl.2015.05.077
BindingDB Entry DOI: 10.7270/Q25D8TMB |
More data for this
Ligand-Target Pair | |
Melanin-concentrating hormone receptor 1
(Homo sapiens (Human)) | BDBM50107738
(CHEMBL3600818)Show SMILES CCNC(=O)N(C)Cc1ccc(CCNC(=O)c2ccc(cc2F)-c2ccc(Cl)cc2)cc1 Show InChI InChI=1S/C26H27ClFN3O2/c1-3-29-26(33)31(2)17-19-6-4-18(5-7-19)14-15-30-25(32)23-13-10-21(16-24(23)28)20-8-11-22(27)12-9-20/h4-13,16H,3,14-15,17H2,1-2H3,(H,29,33)(H,30,32) | Reactome pathway
KEGG
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 36 | n/a | n/a | n/a | n/a | n/a | n/a |
Boehringer Ingelheim Pharma GmbH& Co. KG
Curated by ChEMBL
| Assay Description
Displacement of [125I]-MCH from human MCHR1 expressed in CHO/Galpha16 cell membranes by scintillation counting method |
Bioorg Med Chem Lett 25: 3264-9 (2015)
Article DOI: 10.1016/j.bmcl.2015.05.077
BindingDB Entry DOI: 10.7270/Q25D8TMB |
More data for this
Ligand-Target Pair | |
Melanin-concentrating hormone receptor 1
(Homo sapiens (Human)) | BDBM50107759
(CHEMBL3600802)Show SMILES NCc1ccc(CCNC(=O)c2ccc(cc2)-c2ccc(Cl)cc2)cc1 Show InChI InChI=1S/C22H21ClN2O/c23-21-11-9-19(10-12-21)18-5-7-20(8-6-18)22(26)25-14-13-16-1-3-17(15-24)4-2-16/h1-12H,13-15,24H2,(H,25,26) | Reactome pathway
KEGG
UniProtKB/SwissProt
antibodypedia
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AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 68 | n/a | n/a | n/a | n/a | n/a | n/a |
Boehringer Ingelheim Pharma GmbH& Co. KG
Curated by ChEMBL
| Assay Description
Displacement of [125I]-MCH from human MCHR1 expressed in CHO/Galpha16 cell membranes by scintillation counting method |
Bioorg Med Chem Lett 25: 3264-9 (2015)
Article DOI: 10.1016/j.bmcl.2015.05.077
BindingDB Entry DOI: 10.7270/Q25D8TMB |
More data for this
Ligand-Target Pair | |
Melanin-concentrating hormone receptor 1
(Homo sapiens (Human)) | BDBM50107752
(CHEMBL3601015)Show SMILES Clc1ccc(cc1)-c1ccc(nc1)C#Cc1ccc(OCCN2CCCC2)nn1 Show InChI InChI=1S/C23H21ClN4O/c24-20-6-3-18(4-7-20)19-5-8-21(25-17-19)9-10-22-11-12-23(27-26-22)29-16-15-28-13-1-2-14-28/h3-8,11-12,17H,1-2,13-16H2 | Reactome pathway
KEGG
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PC cid
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UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 77 | n/a | n/a | n/a | n/a | n/a | n/a |
Boehringer Ingelheim Pharma GmbH& Co. KG
Curated by ChEMBL
| Assay Description
Displacement of [125I]-MCH from human MCHR1 expressed in CHO/Galpha16 cell membranes by scintillation counting method |
Bioorg Med Chem Lett 25: 3264-9 (2015)
Article DOI: 10.1016/j.bmcl.2015.05.077
BindingDB Entry DOI: 10.7270/Q25D8TMB |
More data for this
Ligand-Target Pair | |
Melanin-concentrating hormone receptor 1
(Homo sapiens (Human)) | BDBM50107755
(CHEMBL3601018)Show SMILES Clc1ccc(cc1)-c1ccc(cn1)C#Cc1ccc(OCCN2CCCC2)cc1 Show InChI InChI=1S/C25H23ClN2O/c26-23-10-8-22(9-11-23)25-14-7-21(19-27-25)4-3-20-5-12-24(13-6-20)29-18-17-28-15-1-2-16-28/h5-14,19H,1-2,15-18H2 | Reactome pathway
KEGG
UniProtKB/SwissProt
antibodypedia
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AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 78 | n/a | n/a | n/a | n/a | n/a | n/a |
Boehringer Ingelheim Pharma GmbH& Co. KG
Curated by ChEMBL
| Assay Description
Displacement of [125I]-MCH from human MCHR1 expressed in CHO/Galpha16 cell membranes by scintillation counting method |
Bioorg Med Chem Lett 25: 3264-9 (2015)
Article DOI: 10.1016/j.bmcl.2015.05.077
BindingDB Entry DOI: 10.7270/Q25D8TMB |
More data for this
Ligand-Target Pair | |
Muscarinic acetylcholine receptor M1
(Homo sapiens (Human)) | BDBM50107733
(CHEMBL3600801)Show SMILES Clc1ccc(cc1)-c1ccc(cc1)C(=O)NCCc1ccc(CN2CCCC2)cc1 Show InChI InChI=1S/C26H27ClN2O/c27-25-13-11-23(12-14-25)22-7-9-24(10-8-22)26(30)28-16-15-20-3-5-21(6-4-20)19-29-17-1-2-18-29/h3-14H,1-2,15-19H2,(H,28,30) | UniProtKB/SwissProt
antibodypedia
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AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 84 | n/a | n/a | n/a | n/a | n/a | n/a |
Boehringer Ingelheim Pharma GmbH& Co. KG
Curated by ChEMBL
| Assay Description
Inhibition of muscarinic M1 receptor (unknown origin) |
Bioorg Med Chem Lett 25: 3264-9 (2015)
Article DOI: 10.1016/j.bmcl.2015.05.077
BindingDB Entry DOI: 10.7270/Q25D8TMB |
More data for this
Ligand-Target Pair | |
5-hydroxytryptamine receptor 2A
(Homo sapiens (Human)) | BDBM50107733
(CHEMBL3600801)Show SMILES Clc1ccc(cc1)-c1ccc(cc1)C(=O)NCCc1ccc(CN2CCCC2)cc1 Show InChI InChI=1S/C26H27ClN2O/c27-25-13-11-23(12-14-25)22-7-9-24(10-8-22)26(30)28-16-15-20-3-5-21(6-4-20)19-29-17-1-2-18-29/h3-14H,1-2,15-19H2,(H,28,30) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 107 | n/a | n/a | n/a | n/a | n/a | n/a |
Boehringer Ingelheim Pharma GmbH& Co. KG
Curated by ChEMBL
| Assay Description
Inhibition of 5HT2A receptor (unknown origin) |
Bioorg Med Chem Lett 25: 3264-9 (2015)
Article DOI: 10.1016/j.bmcl.2015.05.077
BindingDB Entry DOI: 10.7270/Q25D8TMB |
More data for this
Ligand-Target Pair | |
Melanin-concentrating hormone receptor 1
(Homo sapiens (Human)) | BDBM50107829
(CHEMBL3600826)Show SMILES CCN(CC)CCOc1ccc(cc1)C#Cc1ncc(cn1)-c1ccc(OC)cc1 Show InChI InChI=1S/C25H27N3O2/c1-4-28(5-2)16-17-30-24-11-6-20(7-12-24)8-15-25-26-18-22(19-27-25)21-9-13-23(29-3)14-10-21/h6-7,9-14,18-19H,4-5,16-17H2,1-3H3 | Reactome pathway
KEGG
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 149 | n/a | n/a | n/a | n/a | n/a | n/a |
Boehringer Ingelheim Pharma GmbH& Co. KG
Curated by ChEMBL
| Assay Description
Displacement of [125I]-MCH from human MCHR1 expressed in CHO/Galpha16 cell membranes by scintillation counting method |
Bioorg Med Chem Lett 25: 3264-9 (2015)
Article DOI: 10.1016/j.bmcl.2015.05.077
BindingDB Entry DOI: 10.7270/Q25D8TMB |
More data for this
Ligand-Target Pair | |
Muscarinic acetylcholine receptor M1
(Homo sapiens (Human)) | BDBM50107746
(CHEMBL3600828)Show SMILES Clc1ccc(cc1)-c1ccc(nc1)C#Cc1ccc(OCCN2CCCC2)cc1 Show InChI InChI=1S/C25H23ClN2O/c26-23-9-6-21(7-10-23)22-8-12-24(27-19-22)11-3-20-4-13-25(14-5-20)29-18-17-28-15-1-2-16-28/h4-10,12-14,19H,1-2,15-18H2 | UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 170 | n/a | n/a | n/a | n/a | n/a | n/a |
Boehringer Ingelheim Pharma GmbH& Co. KG
Curated by ChEMBL
| Assay Description
Inhibition of muscarinic M1 receptor (unknown origin) |
Bioorg Med Chem Lett 25: 3264-9 (2015)
Article DOI: 10.1016/j.bmcl.2015.05.077
BindingDB Entry DOI: 10.7270/Q25D8TMB |
More data for this
Ligand-Target Pair | |
Melanin-concentrating hormone receptor 1
(Homo sapiens (Human)) | BDBM50107828
(CHEMBL3600825)Show SMILES CCN(CC)CCOc1ccc(cc1)C#Cc1ccc(cc1)-c1ccc(OC)cc1 Show InChI InChI=1S/C27H29NO2/c1-4-28(5-2)20-21-30-27-16-10-23(11-17-27)7-6-22-8-12-24(13-9-22)25-14-18-26(29-3)19-15-25/h8-19H,4-5,20-21H2,1-3H3 | Reactome pathway
KEGG
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 247 | n/a | n/a | n/a | n/a | n/a | n/a |
Boehringer Ingelheim Pharma GmbH& Co. KG
Curated by ChEMBL
| Assay Description
Displacement of [125I]-MCH from human MCHR1 expressed in CHO/Galpha16 cell membranes by scintillation counting method |
Bioorg Med Chem Lett 25: 3264-9 (2015)
Article DOI: 10.1016/j.bmcl.2015.05.077
BindingDB Entry DOI: 10.7270/Q25D8TMB |
More data for this
Ligand-Target Pair | |
Melanin-concentrating hormone receptor 1
(Homo sapiens (Human)) | BDBM50107758
(CHEMBL3601024)Show SMILES CCN(CC)CCOc1ccc(cc1)C(=O)N(C)c1ccc(cc1)-c1ccc(OC)cc1 Show InChI InChI=1S/C27H32N2O3/c1-5-29(6-2)19-20-32-26-17-11-23(12-18-26)27(30)28(3)24-13-7-21(8-14-24)22-9-15-25(31-4)16-10-22/h7-18H,5-6,19-20H2,1-4H3 | Reactome pathway
KEGG
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 251 | n/a | n/a | n/a | n/a | n/a | n/a |
Boehringer Ingelheim Pharma GmbH& Co. KG
Curated by ChEMBL
| Assay Description
Displacement of [125I]-MCH from human MCHR1 expressed in CHO/Galpha16 cell membranes by scintillation counting method |
Bioorg Med Chem Lett 25: 3264-9 (2015)
Article DOI: 10.1016/j.bmcl.2015.05.077
BindingDB Entry DOI: 10.7270/Q25D8TMB |
More data for this
Ligand-Target Pair | |
Muscarinic acetylcholine receptor M1
(Homo sapiens (Human)) | BDBM50107749
(CHEMBL3601021)Show SMILES CC1CCN(CCOc2ccc(cc2)C#Cc2ncc(cc2F)-c2ccc(Cl)cc2)CC1 Show InChI InChI=1S/C27H26ClFN2O/c1-20-12-14-31(15-13-20)16-17-32-25-9-2-21(3-10-25)4-11-27-26(29)18-23(19-30-27)22-5-7-24(28)8-6-22/h2-3,5-10,18-20H,12-17H2,1H3 | UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 285 | n/a | n/a | n/a | n/a | n/a | n/a |
Boehringer Ingelheim Pharma GmbH& Co. KG
Curated by ChEMBL
| Assay Description
Inhibition of muscarinic M1 receptor (unknown origin) |
Bioorg Med Chem Lett 25: 3264-9 (2015)
Article DOI: 10.1016/j.bmcl.2015.05.077
BindingDB Entry DOI: 10.7270/Q25D8TMB |
More data for this
Ligand-Target Pair | |
5-hydroxytryptamine receptor 2A
(Homo sapiens (Human)) | BDBM50107735
(CHEMBL3600815)Show SMILES CC(=O)NC1CCN(Cc2ccc(CCNC(=O)c3ccc(cc3)-c3ccc(F)cc3)cc2)CC1 Show InChI InChI=1S/C29H32FN3O2/c1-21(34)32-28-15-18-33(19-16-28)20-23-4-2-22(3-5-23)14-17-31-29(35)26-8-6-24(7-9-26)25-10-12-27(30)13-11-25/h2-13,28H,14-20H2,1H3,(H,31,35)(H,32,34) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 360 | n/a | n/a | n/a | n/a | n/a | n/a |
Boehringer Ingelheim Pharma GmbH& Co. KG
Curated by ChEMBL
| Assay Description
Inhibition of 5HT2A receptor (unknown origin) |
Bioorg Med Chem Lett 25: 3264-9 (2015)
Article DOI: 10.1016/j.bmcl.2015.05.077
BindingDB Entry DOI: 10.7270/Q25D8TMB |
More data for this
Ligand-Target Pair | |
Melanin-concentrating hormone receptor 1
(Homo sapiens (Human)) | BDBM50107826
(CHEMBL3600823)Show SMILES CCN(CC)CCOc1ccc(CCc2ccc(cn2)-c2ccc(OC)cc2)cc1 Show InChI InChI=1S/C26H32N2O2/c1-4-28(5-2)18-19-30-26-14-7-21(8-15-26)6-12-24-13-9-23(20-27-24)22-10-16-25(29-3)17-11-22/h7-11,13-17,20H,4-6,12,18-19H2,1-3H3 | Reactome pathway
KEGG
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 360 | n/a | n/a | n/a | n/a | n/a | n/a |
Boehringer Ingelheim Pharma GmbH& Co. KG
Curated by ChEMBL
| Assay Description
Displacement of [125I]-MCH from human MCHR1 expressed in CHO/Galpha16 cell membranes by scintillation counting method |
Bioorg Med Chem Lett 25: 3264-9 (2015)
Article DOI: 10.1016/j.bmcl.2015.05.077
BindingDB Entry DOI: 10.7270/Q25D8TMB |
More data for this
Ligand-Target Pair | |
Melanin-concentrating hormone receptor 1
(Homo sapiens (Human)) | BDBM50107825
(CHEMBL3600822)Show SMILES CCN(CC)CCOc1ccc(\C=C\c2ccc(cn2)-c2ccc(OC)cc2)cc1 Show InChI InChI=1S/C26H30N2O2/c1-4-28(5-2)18-19-30-26-14-7-21(8-15-26)6-12-24-13-9-23(20-27-24)22-10-16-25(29-3)17-11-22/h6-17,20H,4-5,18-19H2,1-3H3/b12-6+ | Reactome pathway
KEGG
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 420 | n/a | n/a | n/a | n/a | n/a | n/a |
Boehringer Ingelheim Pharma GmbH& Co. KG
Curated by ChEMBL
| Assay Description
Displacement of [125I]-MCH from human MCHR1 expressed in CHO/Galpha16 cell membranes by scintillation counting method |
Bioorg Med Chem Lett 25: 3264-9 (2015)
Article DOI: 10.1016/j.bmcl.2015.05.077
BindingDB Entry DOI: 10.7270/Q25D8TMB |
More data for this
Ligand-Target Pair | |
Melanin-concentrating hormone receptor 1
(Homo sapiens (Human)) | BDBM50107765
(CHEMBL3600808)Show SMILES NC(=O)c1cc(CCNC(=O)c2ccc(cc2)-c2ccc(Cl)cc2)ccc1CN1CCCC1 Show InChI InChI=1S/C27H28ClN3O2/c28-24-11-9-21(10-12-24)20-5-7-22(8-6-20)27(33)30-14-13-19-3-4-23(25(17-19)26(29)32)18-31-15-1-2-16-31/h3-12,17H,1-2,13-16,18H2,(H2,29,32)(H,30,33) | Reactome pathway
KEGG
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
| Article
PubMed
| n/a | n/a | 470 | n/a | n/a | n/a | n/a | n/a | n/a |
Boehringer Ingelheim Pharma GmbH& Co. KG
Curated by ChEMBL
| Assay Description
Displacement of [125I]-MCH from human MCHR1 expressed in CHO/Galpha16 cell membranes by scintillation counting method |
Bioorg Med Chem Lett 25: 3264-9 (2015)
Article DOI: 10.1016/j.bmcl.2015.05.077
BindingDB Entry DOI: 10.7270/Q25D8TMB |
More data for this
Ligand-Target Pair | |
5-hydroxytryptamine receptor 2A
(Homo sapiens (Human)) | BDBM50107746
(CHEMBL3600828)Show SMILES Clc1ccc(cc1)-c1ccc(nc1)C#Cc1ccc(OCCN2CCCC2)cc1 Show InChI InChI=1S/C25H23ClN2O/c26-23-9-6-21(7-10-23)22-8-12-24(27-19-22)11-3-20-4-13-25(14-5-20)29-18-17-28-15-1-2-16-28/h4-10,12-14,19H,1-2,15-18H2 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 500 | n/a | n/a | n/a | n/a | n/a | n/a |
Boehringer Ingelheim Pharma GmbH& Co. KG
Curated by ChEMBL
| Assay Description
Inhibition of 5HT2A receptor (unknown origin) |
Bioorg Med Chem Lett 25: 3264-9 (2015)
Article DOI: 10.1016/j.bmcl.2015.05.077
BindingDB Entry DOI: 10.7270/Q25D8TMB |
More data for this
Ligand-Target Pair | |
Cytochrome P450 2D6
(Homo sapiens (Human)) | BDBM50107733
(CHEMBL3600801)Show SMILES Clc1ccc(cc1)-c1ccc(cc1)C(=O)NCCc1ccc(CN2CCCC2)cc1 Show InChI InChI=1S/C26H27ClN2O/c27-25-13-11-23(12-14-25)22-7-9-24(10-8-22)26(30)28-16-15-20-3-5-21(6-4-20)19-29-17-1-2-18-29/h3-14H,1-2,15-19H2,(H,28,30) | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 500 | n/a | n/a | n/a | n/a | n/a | n/a |
Boehringer Ingelheim Pharma GmbH& Co. KG
Curated by ChEMBL
| Assay Description
Inhibition of CYP2D6 receptor (unknown origin) |
Bioorg Med Chem Lett 25: 3264-9 (2015)
Article DOI: 10.1016/j.bmcl.2015.05.077
BindingDB Entry DOI: 10.7270/Q25D8TMB |
More data for this
Ligand-Target Pair | |
5-hydroxytryptamine receptor 2A
(Homo sapiens (Human)) | BDBM50107737
(CHEMBL3600817)Show SMILES CC(=O)CNC1CCN(Cc2ccc(CCNC(=O)c3ccc(cc3)-c3ccc(F)cc3)cc2)CC1 Show InChI InChI=1S/C30H34FN3O2/c1-22(35)20-33-29-15-18-34(19-16-29)21-24-4-2-23(3-5-24)14-17-32-30(36)27-8-6-25(7-9-27)26-10-12-28(31)13-11-26/h2-13,29,33H,14-21H2,1H3,(H,32,36) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 528 | n/a | n/a | n/a | n/a | n/a | n/a |
Boehringer Ingelheim Pharma GmbH& Co. KG
Curated by ChEMBL
| Assay Description
Inhibition of 5HT2A receptor (unknown origin) |
Bioorg Med Chem Lett 25: 3264-9 (2015)
Article DOI: 10.1016/j.bmcl.2015.05.077
BindingDB Entry DOI: 10.7270/Q25D8TMB |
More data for this
Ligand-Target Pair | |
Muscarinic acetylcholine receptor M1
(Homo sapiens (Human)) | BDBM50107751
(CHEMBL3601023)Show SMILES Cc1cc(ccc1OCCN1CCC[C@H]1CO)C#Cc1ccc(cn1)-c1ccc(Cl)cc1 |r| Show InChI InChI=1S/C27H27ClN2O2/c1-20-17-21(5-13-27(20)32-16-15-30-14-2-3-26(30)19-31)4-11-25-12-8-23(18-29-25)22-6-9-24(28)10-7-22/h5-10,12-13,17-18,26,31H,2-3,14-16,19H2,1H3/t26-/m0/s1 | UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 665 | n/a | n/a | n/a | n/a | n/a | n/a |
Boehringer Ingelheim Pharma GmbH& Co. KG
Curated by ChEMBL
| Assay Description
Inhibition of muscarinic M1 receptor (unknown origin) |
Bioorg Med Chem Lett 25: 3264-9 (2015)
Article DOI: 10.1016/j.bmcl.2015.05.077
BindingDB Entry DOI: 10.7270/Q25D8TMB |
More data for this
Ligand-Target Pair | |
Melanin-concentrating hormone receptor 1
(Homo sapiens (Human)) | BDBM50107824
(CHEMBL3600821)Show SMILES CCN(CC)CCOc1ccc(\C=C/c2ccc(cn2)-c2ccc(OC)cc2)cc1 Show InChI InChI=1S/C26H30N2O2/c1-4-28(5-2)18-19-30-26-14-7-21(8-15-26)6-12-24-13-9-23(20-27-24)22-10-16-25(29-3)17-11-22/h6-17,20H,4-5,18-19H2,1-3H3/b12-6- | Reactome pathway
KEGG
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 700 | n/a | n/a | n/a | n/a | n/a | n/a |
Boehringer Ingelheim Pharma GmbH& Co. KG
Curated by ChEMBL
| Assay Description
Displacement of [125I]-MCH from human MCHR1 expressed in CHO/Galpha16 cell membranes by scintillation counting method |
Bioorg Med Chem Lett 25: 3264-9 (2015)
Article DOI: 10.1016/j.bmcl.2015.05.077
BindingDB Entry DOI: 10.7270/Q25D8TMB |
More data for this
Ligand-Target Pair | |
Muscarinic acetylcholine receptor M1
(Homo sapiens (Human)) | BDBM50107734
(CHEMBL3600814)Show SMILES CC(=O)N1CCN(Cc2ccc(CCNC(=O)c3ccc(cc3)-c3ccc(Cl)cc3)cc2)CC1 Show InChI InChI=1S/C28H30ClN3O2/c1-21(33)32-18-16-31(17-19-32)20-23-4-2-22(3-5-23)14-15-30-28(34)26-8-6-24(7-9-26)25-10-12-27(29)13-11-25/h2-13H,14-20H2,1H3,(H,30,34) | UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 877 | n/a | n/a | n/a | n/a | n/a | n/a |
Boehringer Ingelheim Pharma GmbH& Co. KG
Curated by ChEMBL
| Assay Description
Inhibition of muscarinic M1 receptor (unknown origin) |
Bioorg Med Chem Lett 25: 3264-9 (2015)
Article DOI: 10.1016/j.bmcl.2015.05.077
BindingDB Entry DOI: 10.7270/Q25D8TMB |
More data for this
Ligand-Target Pair | |
5-hydroxytryptamine receptor 2A
(Homo sapiens (Human)) | BDBM50107747
(CHEMBL3600830)Show SMILES CC1CCN(CCOc2ccc(cc2)C#Cc2ccc(cn2)-c2ccc(Cl)cc2)CC1 Show InChI InChI=1S/C27H27ClN2O/c1-21-14-16-30(17-15-21)18-19-31-27-12-3-22(4-13-27)2-10-26-11-7-24(20-29-26)23-5-8-25(28)9-6-23/h3-9,11-13,20-21H,14-19H2,1H3 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 1.35E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Boehringer Ingelheim Pharma GmbH& Co. KG
Curated by ChEMBL
| Assay Description
Inhibition of 5HT2A receptor (unknown origin) |
Bioorg Med Chem Lett 25: 3264-9 (2015)
Article DOI: 10.1016/j.bmcl.2015.05.077
BindingDB Entry DOI: 10.7270/Q25D8TMB |
More data for this
Ligand-Target Pair | |
5-hydroxytryptamine receptor 2A
(Homo sapiens (Human)) | BDBM50107750
(CHEMBL3601022)Show SMILES OC[C@H]1CCCN1CCOc1ccc(cc1)C#Cc1ccc(cn1)-c1ccc(Cl)cc1 |r| Show InChI InChI=1S/C26H25ClN2O2/c27-23-9-6-21(7-10-23)22-8-12-24(28-18-22)11-3-20-4-13-26(14-5-20)31-17-16-29-15-1-2-25(29)19-30/h4-10,12-14,18,25,30H,1-2,15-17,19H2/t25-/m1/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 1.64E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Boehringer Ingelheim Pharma GmbH& Co. KG
Curated by ChEMBL
| Assay Description
Inhibition of 5HT2A receptor (unknown origin) |
Bioorg Med Chem Lett 25: 3264-9 (2015)
Article DOI: 10.1016/j.bmcl.2015.05.077
BindingDB Entry DOI: 10.7270/Q25D8TMB |
More data for this
Ligand-Target Pair | |
Muscarinic acetylcholine receptor M1
(Homo sapiens (Human)) | BDBM50107747
(CHEMBL3600830)Show SMILES CC1CCN(CCOc2ccc(cc2)C#Cc2ccc(cn2)-c2ccc(Cl)cc2)CC1 Show InChI InChI=1S/C27H27ClN2O/c1-21-14-16-30(17-15-21)18-19-31-27-12-3-22(4-13-27)2-10-26-11-7-24(20-29-26)23-5-8-25(28)9-6-23/h3-9,11-13,20-21H,14-19H2,1H3 | UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 2.21E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Boehringer Ingelheim Pharma GmbH& Co. KG
Curated by ChEMBL
| Assay Description
Inhibition of muscarinic M1 receptor (unknown origin) |
Bioorg Med Chem Lett 25: 3264-9 (2015)
Article DOI: 10.1016/j.bmcl.2015.05.077
BindingDB Entry DOI: 10.7270/Q25D8TMB |
More data for this
Ligand-Target Pair | |
5-hydroxytryptamine receptor 2A
(Homo sapiens (Human)) | BDBM50107734
(CHEMBL3600814)Show SMILES CC(=O)N1CCN(Cc2ccc(CCNC(=O)c3ccc(cc3)-c3ccc(Cl)cc3)cc2)CC1 Show InChI InChI=1S/C28H30ClN3O2/c1-21(33)32-18-16-31(17-19-32)20-23-4-2-22(3-5-23)14-15-30-28(34)26-8-6-24(7-9-26)25-10-12-27(29)13-11-25/h2-13H,14-20H2,1H3,(H,30,34) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 2.33E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Boehringer Ingelheim Pharma GmbH& Co. KG
Curated by ChEMBL
| Assay Description
Inhibition of 5HT2A receptor (unknown origin) |
Bioorg Med Chem Lett 25: 3264-9 (2015)
Article DOI: 10.1016/j.bmcl.2015.05.077
BindingDB Entry DOI: 10.7270/Q25D8TMB |
More data for this
Ligand-Target Pair | |
Cytochrome P450 2D6
(Homo sapiens (Human)) | BDBM50107737
(CHEMBL3600817)Show SMILES CC(=O)CNC1CCN(Cc2ccc(CCNC(=O)c3ccc(cc3)-c3ccc(F)cc3)cc2)CC1 Show InChI InChI=1S/C30H34FN3O2/c1-22(35)20-33-29-15-18-34(19-16-29)21-24-4-2-23(3-5-24)14-17-32-30(36)27-8-6-25(7-9-27)26-10-12-28(31)13-11-26/h2-13,29,33H,14-21H2,1H3,(H,32,36) | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 2.40E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Boehringer Ingelheim Pharma GmbH& Co. KG
Curated by ChEMBL
| Assay Description
Inhibition of CYP2D6 receptor (unknown origin) |
Bioorg Med Chem Lett 25: 3264-9 (2015)
Article DOI: 10.1016/j.bmcl.2015.05.077
BindingDB Entry DOI: 10.7270/Q25D8TMB |
More data for this
Ligand-Target Pair | |
Muscarinic acetylcholine receptor M1
(Homo sapiens (Human)) | BDBM50107737
(CHEMBL3600817)Show SMILES CC(=O)CNC1CCN(Cc2ccc(CCNC(=O)c3ccc(cc3)-c3ccc(F)cc3)cc2)CC1 Show InChI InChI=1S/C30H34FN3O2/c1-22(35)20-33-29-15-18-34(19-16-29)21-24-4-2-23(3-5-24)14-17-32-30(36)27-8-6-25(7-9-27)26-10-12-28(31)13-11-26/h2-13,29,33H,14-21H2,1H3,(H,32,36) | UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 2.52E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Boehringer Ingelheim Pharma GmbH& Co. KG
Curated by ChEMBL
| Assay Description
Inhibition of muscarinic M1 receptor (unknown origin) |
Bioorg Med Chem Lett 25: 3264-9 (2015)
Article DOI: 10.1016/j.bmcl.2015.05.077
BindingDB Entry DOI: 10.7270/Q25D8TMB |
More data for this
Ligand-Target Pair | |
Muscarinic acetylcholine receptor M1
(Homo sapiens (Human)) | BDBM50107750
(CHEMBL3601022)Show SMILES OC[C@H]1CCCN1CCOc1ccc(cc1)C#Cc1ccc(cn1)-c1ccc(Cl)cc1 |r| Show InChI InChI=1S/C26H25ClN2O2/c27-23-9-6-21(7-10-23)22-8-12-24(28-18-22)11-3-20-4-13-26(14-5-20)31-17-16-29-15-1-2-25(29)19-30/h4-10,12-14,18,25,30H,1-2,15-17,19H2/t25-/m1/s1 | UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 2.89E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Boehringer Ingelheim Pharma GmbH& Co. KG
Curated by ChEMBL
| Assay Description
Inhibition of muscarinic M1 receptor (unknown origin) |
Bioorg Med Chem Lett 25: 3264-9 (2015)
Article DOI: 10.1016/j.bmcl.2015.05.077
BindingDB Entry DOI: 10.7270/Q25D8TMB |
More data for this
Ligand-Target Pair | |
5-hydroxytryptamine receptor 2A
(Homo sapiens (Human)) | BDBM50107749
(CHEMBL3601021)Show SMILES CC1CCN(CCOc2ccc(cc2)C#Cc2ncc(cc2F)-c2ccc(Cl)cc2)CC1 Show InChI InChI=1S/C27H26ClFN2O/c1-20-12-14-31(15-13-20)16-17-32-25-9-2-21(3-10-25)4-11-27-26(29)18-23(19-30-27)22-5-7-24(28)8-6-22/h2-3,5-10,18-20H,12-17H2,1H3 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 3.29E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Boehringer Ingelheim Pharma GmbH& Co. KG
Curated by ChEMBL
| Assay Description
Inhibition of 5HT2A receptor (unknown origin) |
Bioorg Med Chem Lett 25: 3264-9 (2015)
Article DOI: 10.1016/j.bmcl.2015.05.077
BindingDB Entry DOI: 10.7270/Q25D8TMB |
More data for this
Ligand-Target Pair | |
Cytochrome P450 2D6
(Homo sapiens (Human)) | BDBM50107746
(CHEMBL3600828)Show SMILES Clc1ccc(cc1)-c1ccc(nc1)C#Cc1ccc(OCCN2CCCC2)cc1 Show InChI InChI=1S/C25H23ClN2O/c26-23-9-6-21(7-10-23)22-8-12-24(27-19-22)11-3-20-4-13-25(14-5-20)29-18-17-28-15-1-2-16-28/h4-10,12-14,19H,1-2,15-18H2 | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 6.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Boehringer Ingelheim Pharma GmbH& Co. KG
Curated by ChEMBL
| Assay Description
Inhibition of CYP2D6 receptor (unknown origin) |
Bioorg Med Chem Lett 25: 3264-9 (2015)
Article DOI: 10.1016/j.bmcl.2015.05.077
BindingDB Entry DOI: 10.7270/Q25D8TMB |
More data for this
Ligand-Target Pair | |
Cytochrome P450 2D6
(Homo sapiens (Human)) | BDBM50107735
(CHEMBL3600815)Show SMILES CC(=O)NC1CCN(Cc2ccc(CCNC(=O)c3ccc(cc3)-c3ccc(F)cc3)cc2)CC1 Show InChI InChI=1S/C29H32FN3O2/c1-21(34)32-28-15-18-33(19-16-28)20-23-4-2-22(3-5-23)14-17-31-29(35)26-8-6-24(7-9-26)25-10-12-27(30)13-11-25/h2-13,28H,14-20H2,1H3,(H,31,35)(H,32,34) | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 6.50E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Boehringer Ingelheim Pharma GmbH& Co. KG
Curated by ChEMBL
| Assay Description
Inhibition of CYP2D6 receptor (unknown origin) |
Bioorg Med Chem Lett 25: 3264-9 (2015)
Article DOI: 10.1016/j.bmcl.2015.05.077
BindingDB Entry DOI: 10.7270/Q25D8TMB |
More data for this
Ligand-Target Pair | |
5-hydroxytryptamine receptor 2A
(Homo sapiens (Human)) | BDBM50107738
(CHEMBL3600818)Show SMILES CCNC(=O)N(C)Cc1ccc(CCNC(=O)c2ccc(cc2F)-c2ccc(Cl)cc2)cc1 Show InChI InChI=1S/C26H27ClFN3O2/c1-3-29-26(33)31(2)17-19-6-4-18(5-7-19)14-15-30-25(32)23-13-10-21(16-24(23)28)20-8-11-22(27)12-9-20/h4-13,16H,3,14-15,17H2,1-2H3,(H,29,33)(H,30,32) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 8.15E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Boehringer Ingelheim Pharma GmbH& Co. KG
Curated by ChEMBL
| Assay Description
Inhibition of 5HT2A receptor (unknown origin) |
Bioorg Med Chem Lett 25: 3264-9 (2015)
Article DOI: 10.1016/j.bmcl.2015.05.077
BindingDB Entry DOI: 10.7270/Q25D8TMB |
More data for this
Ligand-Target Pair | |
Muscarinic acetylcholine receptor M1
(Homo sapiens (Human)) | BDBM50107735
(CHEMBL3600815)Show SMILES CC(=O)NC1CCN(Cc2ccc(CCNC(=O)c3ccc(cc3)-c3ccc(F)cc3)cc2)CC1 Show InChI InChI=1S/C29H32FN3O2/c1-21(34)32-28-15-18-33(19-16-28)20-23-4-2-22(3-5-23)14-17-31-29(35)26-8-6-24(7-9-26)25-10-12-27(30)13-11-25/h2-13,28H,14-20H2,1H3,(H,31,35)(H,32,34) | UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 8.62E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Boehringer Ingelheim Pharma GmbH& Co. KG
Curated by ChEMBL
| Assay Description
Inhibition of muscarinic M1 receptor (unknown origin) |
Bioorg Med Chem Lett 25: 3264-9 (2015)
Article DOI: 10.1016/j.bmcl.2015.05.077
BindingDB Entry DOI: 10.7270/Q25D8TMB |
More data for this
Ligand-Target Pair | |
5-hydroxytryptamine receptor 2A
(Homo sapiens (Human)) | BDBM50107748
(CHEMBL3600831)Show SMILES NC(=O)C1CCN(CCOc2ccc(cc2)C#Cc2ccc(cn2)-c2ccc(Cl)cc2)CC1 Show InChI InChI=1S/C27H26ClN3O2/c28-24-7-4-21(5-8-24)23-6-10-25(30-19-23)9-1-20-2-11-26(12-3-20)33-18-17-31-15-13-22(14-16-31)27(29)32/h2-8,10-12,19,22H,13-18H2,(H2,29,32) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | >1.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Boehringer Ingelheim Pharma GmbH& Co. KG
Curated by ChEMBL
| Assay Description
Inhibition of 5HT2A receptor (unknown origin) |
Bioorg Med Chem Lett 25: 3264-9 (2015)
Article DOI: 10.1016/j.bmcl.2015.05.077
BindingDB Entry DOI: 10.7270/Q25D8TMB |
More data for this
Ligand-Target Pair | |
Muscarinic acetylcholine receptor M1
(Homo sapiens (Human)) | BDBM50107748
(CHEMBL3600831)Show SMILES NC(=O)C1CCN(CCOc2ccc(cc2)C#Cc2ccc(cn2)-c2ccc(Cl)cc2)CC1 Show InChI InChI=1S/C27H26ClN3O2/c28-24-7-4-21(5-8-24)23-6-10-25(30-19-23)9-1-20-2-11-26(12-3-20)33-18-17-31-15-13-22(14-16-31)27(29)32/h2-8,10-12,19,22H,13-18H2,(H2,29,32) | UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | >1.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Boehringer Ingelheim Pharma GmbH& Co. KG
Curated by ChEMBL
| Assay Description
Inhibition of muscarinic M1 receptor (unknown origin) |
Bioorg Med Chem Lett 25: 3264-9 (2015)
Article DOI: 10.1016/j.bmcl.2015.05.077
BindingDB Entry DOI: 10.7270/Q25D8TMB |
More data for this
Ligand-Target Pair | |
Muscarinic acetylcholine receptor M1
(Homo sapiens (Human)) | BDBM50107738
(CHEMBL3600818)Show SMILES CCNC(=O)N(C)Cc1ccc(CCNC(=O)c2ccc(cc2F)-c2ccc(Cl)cc2)cc1 Show InChI InChI=1S/C26H27ClFN3O2/c1-3-29-26(33)31(2)17-19-6-4-18(5-7-19)14-15-30-25(32)23-13-10-21(16-24(23)28)20-8-11-22(27)12-9-20/h4-13,16H,3,14-15,17H2,1-2H3,(H,29,33)(H,30,32) | UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | >1.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Boehringer Ingelheim Pharma GmbH& Co. KG
Curated by ChEMBL
| Assay Description
Inhibition of muscarinic M1 receptor (unknown origin) |
Bioorg Med Chem Lett 25: 3264-9 (2015)
Article DOI: 10.1016/j.bmcl.2015.05.077
BindingDB Entry DOI: 10.7270/Q25D8TMB |
More data for this
Ligand-Target Pair | |
5-hydroxytryptamine receptor 2A
(Homo sapiens (Human)) | BDBM50107751
(CHEMBL3601023)Show SMILES Cc1cc(ccc1OCCN1CCC[C@H]1CO)C#Cc1ccc(cn1)-c1ccc(Cl)cc1 |r| Show InChI InChI=1S/C27H27ClN2O2/c1-20-17-21(5-13-27(20)32-16-15-30-14-2-3-26(30)19-31)4-11-25-12-8-23(18-29-25)22-6-9-24(28)10-7-22/h5-10,12-13,17-18,26,31H,2-3,14-16,19H2,1H3/t26-/m0/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | >1.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Boehringer Ingelheim Pharma GmbH& Co. KG
Curated by ChEMBL
| Assay Description
Inhibition of 5HT2A receptor (unknown origin) |
Bioorg Med Chem Lett 25: 3264-9 (2015)
Article DOI: 10.1016/j.bmcl.2015.05.077
BindingDB Entry DOI: 10.7270/Q25D8TMB |
More data for this
Ligand-Target Pair | |
Cytochrome P450 2D6
(Homo sapiens (Human)) | BDBM50107747
(CHEMBL3600830)Show SMILES CC1CCN(CCOc2ccc(cc2)C#Cc2ccc(cn2)-c2ccc(Cl)cc2)CC1 Show InChI InChI=1S/C27H27ClN2O/c1-21-14-16-30(17-15-21)18-19-31-27-12-3-22(4-13-27)2-10-26-11-7-24(20-29-26)23-5-8-25(28)9-6-23/h3-9,11-13,20-21H,14-19H2,1H3 | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | >1.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Boehringer Ingelheim Pharma GmbH& Co. KG
Curated by ChEMBL
| Assay Description
Inhibition of CYP2D6 receptor (unknown origin) |
Bioorg Med Chem Lett 25: 3264-9 (2015)
Article DOI: 10.1016/j.bmcl.2015.05.077
BindingDB Entry DOI: 10.7270/Q25D8TMB |
More data for this
Ligand-Target Pair | |
Muscarinic acetylcholine receptor M1
(Homo sapiens (Human)) | BDBM50107736
(CHEMBL3600816)Show SMILES CN(CCc1ccc(CN2CCC(CC2)NC(C)=O)cc1)C(=O)c1ccc(cc1)-c1ccc(F)cc1 Show InChI InChI=1S/C30H34FN3O2/c1-22(35)32-29-16-19-34(20-17-29)21-24-5-3-23(4-6-24)15-18-33(2)30(36)27-9-7-25(8-10-27)26-11-13-28(31)14-12-26/h3-14,29H,15-21H2,1-2H3,(H,32,35) | UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | >1.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Boehringer Ingelheim Pharma GmbH& Co. KG
Curated by ChEMBL
| Assay Description
Inhibition of muscarinic M1 receptor (unknown origin) |
Bioorg Med Chem Lett 25: 3264-9 (2015)
Article DOI: 10.1016/j.bmcl.2015.05.077
BindingDB Entry DOI: 10.7270/Q25D8TMB |
More data for this
Ligand-Target Pair | |
5-hydroxytryptamine receptor 2A
(Homo sapiens (Human)) | BDBM50107736
(CHEMBL3600816)Show SMILES CN(CCc1ccc(CN2CCC(CC2)NC(C)=O)cc1)C(=O)c1ccc(cc1)-c1ccc(F)cc1 Show InChI InChI=1S/C30H34FN3O2/c1-22(35)32-29-16-19-34(20-17-29)21-24-5-3-23(4-6-24)15-18-33(2)30(36)27-9-7-25(8-10-27)26-11-13-28(31)14-12-26/h3-14,29H,15-21H2,1-2H3,(H,32,35) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | >1.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Boehringer Ingelheim Pharma GmbH& Co. KG
Curated by ChEMBL
| Assay Description
Inhibition of 5HT2A receptor (unknown origin) |
Bioorg Med Chem Lett 25: 3264-9 (2015)
Article DOI: 10.1016/j.bmcl.2015.05.077
BindingDB Entry DOI: 10.7270/Q25D8TMB |
More data for this
Ligand-Target Pair | |
Cytochrome P450 2D6
(Homo sapiens (Human)) | BDBM50107736
(CHEMBL3600816)Show SMILES CN(CCc1ccc(CN2CCC(CC2)NC(C)=O)cc1)C(=O)c1ccc(cc1)-c1ccc(F)cc1 Show InChI InChI=1S/C30H34FN3O2/c1-22(35)32-29-16-19-34(20-17-29)21-24-5-3-23(4-6-24)15-18-33(2)30(36)27-9-7-25(8-10-27)26-11-13-28(31)14-12-26/h3-14,29H,15-21H2,1-2H3,(H,32,35) | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 1.50E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Boehringer Ingelheim Pharma GmbH& Co. KG
Curated by ChEMBL
| Assay Description
Inhibition of CYP2D6 receptor (unknown origin) |
Bioorg Med Chem Lett 25: 3264-9 (2015)
Article DOI: 10.1016/j.bmcl.2015.05.077
BindingDB Entry DOI: 10.7270/Q25D8TMB |
More data for this
Ligand-Target Pair | |
Cytochrome P450 2D6
(Homo sapiens (Human)) | BDBM50107738
(CHEMBL3600818)Show SMILES CCNC(=O)N(C)Cc1ccc(CCNC(=O)c2ccc(cc2F)-c2ccc(Cl)cc2)cc1 Show InChI InChI=1S/C26H27ClFN3O2/c1-3-29-26(33)31(2)17-19-6-4-18(5-7-19)14-15-30-25(32)23-13-10-21(16-24(23)28)20-8-11-22(27)12-9-20/h4-13,16H,3,14-15,17H2,1-2H3,(H,29,33)(H,30,32) | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | >5.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Boehringer Ingelheim Pharma GmbH& Co. KG
Curated by ChEMBL
| Assay Description
Inhibition of CYP2D6 receptor (unknown origin) |
Bioorg Med Chem Lett 25: 3264-9 (2015)
Article DOI: 10.1016/j.bmcl.2015.05.077
BindingDB Entry DOI: 10.7270/Q25D8TMB |
More data for this
Ligand-Target Pair | |
Cytochrome P450 2D6
(Homo sapiens (Human)) | BDBM50107748
(CHEMBL3600831)Show SMILES NC(=O)C1CCN(CCOc2ccc(cc2)C#Cc2ccc(cn2)-c2ccc(Cl)cc2)CC1 Show InChI InChI=1S/C27H26ClN3O2/c28-24-7-4-21(5-8-24)23-6-10-25(30-19-23)9-1-20-2-11-26(12-3-20)33-18-17-31-15-13-22(14-16-31)27(29)32/h2-8,10-12,19,22H,13-18H2,(H2,29,32) | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | >5.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Boehringer Ingelheim Pharma GmbH& Co. KG
Curated by ChEMBL
| Assay Description
Inhibition of CYP2D6 receptor (unknown origin) |
Bioorg Med Chem Lett 25: 3264-9 (2015)
Article DOI: 10.1016/j.bmcl.2015.05.077
BindingDB Entry DOI: 10.7270/Q25D8TMB |
More data for this
Ligand-Target Pair | |
Cytochrome P450 2D6
(Homo sapiens (Human)) | BDBM50107751
(CHEMBL3601023)Show SMILES Cc1cc(ccc1OCCN1CCC[C@H]1CO)C#Cc1ccc(cn1)-c1ccc(Cl)cc1 |r| Show InChI InChI=1S/C27H27ClN2O2/c1-20-17-21(5-13-27(20)32-16-15-30-14-2-3-26(30)19-31)4-11-25-12-8-23(18-29-25)22-6-9-24(28)10-7-22/h5-10,12-13,17-18,26,31H,2-3,14-16,19H2,1H3/t26-/m0/s1 | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | >5.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Boehringer Ingelheim Pharma GmbH& Co. KG
Curated by ChEMBL
| Assay Description
Inhibition of CYP2D6 receptor (unknown origin) |
Bioorg Med Chem Lett 25: 3264-9 (2015)
Article DOI: 10.1016/j.bmcl.2015.05.077
BindingDB Entry DOI: 10.7270/Q25D8TMB |
More data for this
Ligand-Target Pair | |
Cytochrome P450 2D6
(Homo sapiens (Human)) | BDBM50107750
(CHEMBL3601022)Show SMILES OC[C@H]1CCCN1CCOc1ccc(cc1)C#Cc1ccc(cn1)-c1ccc(Cl)cc1 |r| Show InChI InChI=1S/C26H25ClN2O2/c27-23-9-6-21(7-10-23)22-8-12-24(28-18-22)11-3-20-4-13-26(14-5-20)31-17-16-29-15-1-2-25(29)19-30/h4-10,12-14,18,25,30H,1-2,15-17,19H2/t25-/m1/s1 | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | >5.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Boehringer Ingelheim Pharma GmbH& Co. KG
Curated by ChEMBL
| Assay Description
Inhibition of CYP2D6 receptor (unknown origin) |
Bioorg Med Chem Lett 25: 3264-9 (2015)
Article DOI: 10.1016/j.bmcl.2015.05.077
BindingDB Entry DOI: 10.7270/Q25D8TMB |
More data for this
Ligand-Target Pair | |
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