Found 60 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 |
|---|
Histamine H3 receptor
(Homo sapiens (Human)) | BDBM50360974
(CHEMBL1935426)Show SMILES O=S1(=O)CCC(COc2ccc3OC4(CCN(CC4)C4CCC4)CCc3c2)CC1 Show InChI InChI=1S/C23H33NO4S/c25-29(26)14-7-18(8-15-29)17-27-21-4-5-22-19(16-21)6-9-23(28-22)10-12-24(13-11-23)20-2-1-3-20/h4-5,16,18,20H,1-3,6-15,17H2 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet 
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| 4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Cephalon, Inc.
Curated by ChEMBL
| Assay Description
Binding affinity to human histamine H3 receptor |
Bioorg Med Chem Lett 22: 186-9 (2011)
Article DOI: 10.1016/j.bmcl.2011.11.038
BindingDB Entry DOI: 10.7270/Q2NS0VB8 |
More data for this
Ligand-Target Pair | |
Histamine H3 receptor
(Homo sapiens (Human)) | BDBM50360973
(CHEMBL1935425)Show SMILES O=S1(=O)CCC(CC1)Oc1ccc2OC3(CCN(CC3)C3CCC3)CCc2c1 Show InChI InChI=1S/C22H31NO4S/c24-28(25)14-7-19(8-15-28)26-20-4-5-21-17(16-20)6-9-22(27-21)10-12-23(13-11-22)18-2-1-3-18/h4-5,16,18-19H,1-3,6-15H2 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| 7 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Cephalon, Inc.
Curated by ChEMBL
| Assay Description
Binding affinity to human histamine H3 receptor |
Bioorg Med Chem Lett 22: 186-9 (2011)
Article DOI: 10.1016/j.bmcl.2011.11.038
BindingDB Entry DOI: 10.7270/Q2NS0VB8 |
More data for this
Ligand-Target Pair | |
Histamine H3 receptor
(Rattus norvegicus (rat)) | BDBM50360974
(CHEMBL1935426)Show SMILES O=S1(=O)CCC(COc2ccc3OC4(CCN(CC4)C4CCC4)CCc3c2)CC1 Show InChI InChI=1S/C23H33NO4S/c25-29(26)14-7-18(8-15-29)17-27-21-4-5-22-19(16-21)6-9-23(28-22)10-12-24(13-11-23)20-2-1-3-20/h4-5,16,18,20H,1-3,6-15,17H2 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| 9 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Cephalon, Inc.
Curated by ChEMBL
| Assay Description
Binding affinity to rat histamine H3 receptor |
Bioorg Med Chem Lett 22: 186-9 (2011)
Article DOI: 10.1016/j.bmcl.2011.11.038
BindingDB Entry DOI: 10.7270/Q2NS0VB8 |
More data for this
Ligand-Target Pair | |
Histamine H3 receptor
(Homo sapiens (Human)) | BDBM50360989
(CHEMBL1935416)Show SMILES CS(=O)(=O)CCCOc1ccc2OC3(CCN(CC3)C3CCC3)CCc2c1 Show InChI InChI=1S/C21H31NO4S/c1-27(23,24)15-3-14-25-19-6-7-20-17(16-19)8-9-21(26-20)10-12-22(13-11-21)18-4-2-5-18/h6-7,16,18H,2-5,8-15H2,1H3 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 10 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Cephalon, Inc.
Curated by ChEMBL
| Assay Description
Binding affinity to human histamine H3 receptor |
Bioorg Med Chem Lett 22: 186-9 (2011)
Article DOI: 10.1016/j.bmcl.2011.11.038
BindingDB Entry DOI: 10.7270/Q2NS0VB8 |
More data for this
Ligand-Target Pair | |
Histamine H3 receptor
(Homo sapiens (Human)) | BDBM50360978
(CHEMBL1935423)Show SMILES C(Oc1ccc2OC3(CCN(CC3)C3CCC3)CCc2c1)C1CCSCC1 Show InChI InChI=1S/C23H33NO2S/c1-2-20(3-1)24-12-10-23(11-13-24)9-6-19-16-21(4-5-22(19)26-23)25-17-18-7-14-27-15-8-18/h4-5,16,18,20H,1-3,6-15,17H2 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| 12 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Cephalon, Inc.
Curated by ChEMBL
| Assay Description
Binding affinity to human histamine H3 receptor |
Bioorg Med Chem Lett 22: 186-9 (2011)
Article DOI: 10.1016/j.bmcl.2011.11.038
BindingDB Entry DOI: 10.7270/Q2NS0VB8 |
More data for this
Ligand-Target Pair | |
Histamine H3 receptor
(Homo sapiens (Human)) | BDBM50360976
(CHEMBL1933091)Show InChI InChI=1S/C22H31NO3/c1-2-18(3-1)23-12-10-22(11-13-23)9-6-17-16-20(4-5-21(17)26-22)25-19-7-14-24-15-8-19/h4-5,16,18-19H,1-3,6-15H2 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| 15 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Cephalon, Inc.
Curated by ChEMBL
| Assay Description
Binding affinity to human histamine H3 receptor |
Bioorg Med Chem Lett 22: 186-9 (2011)
Article DOI: 10.1016/j.bmcl.2011.11.038
BindingDB Entry DOI: 10.7270/Q2NS0VB8 |
More data for this
Ligand-Target Pair | |
Histamine H3 receptor
(Homo sapiens (Human)) | BDBM50360982
(CHEMBL1935409)Show SMILES CC[C@@H](O)COc1ccc2OC3(CCN(CC3)C3CCC3)CCc2c1 |r| Show InChI InChI=1S/C21H31NO3/c1-2-18(23)15-24-19-6-7-20-16(14-19)8-9-21(25-20)10-12-22(13-11-21)17-4-3-5-17/h6-7,14,17-18,23H,2-5,8-13,15H2,1H3/t18-/m1/s1 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 15 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Cephalon, Inc.
Curated by ChEMBL
| Assay Description
Binding affinity to human histamine H3 receptor |
Bioorg Med Chem Lett 22: 186-9 (2011)
Article DOI: 10.1016/j.bmcl.2011.11.038
BindingDB Entry DOI: 10.7270/Q2NS0VB8 |
More data for this
Ligand-Target Pair | |
Histamine H3 receptor
(Homo sapiens (Human)) | BDBM50360987
(CHEMBL1935414)Show InChI InChI=1S/C21H31NO2S/c1-25-15-3-14-23-19-6-7-20-17(16-19)8-9-21(24-20)10-12-22(13-11-21)18-4-2-5-18/h6-7,16,18H,2-5,8-15H2,1H3 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 15 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Cephalon, Inc.
Curated by ChEMBL
| Assay Description
Binding affinity to human histamine H3 receptor |
Bioorg Med Chem Lett 22: 186-9 (2011)
Article DOI: 10.1016/j.bmcl.2011.11.038
BindingDB Entry DOI: 10.7270/Q2NS0VB8 |
More data for this
Ligand-Target Pair | |
Histamine H3 receptor
(Homo sapiens (Human)) | BDBM50360991
(CHEMBL1935418)Show SMILES C1CC(C1)N1CCC2(CC1)CCc1cc(O[C@H]3CCOC3)ccc1O2 |r| Show InChI InChI=1S/C21H29NO3/c1-2-17(3-1)22-11-9-21(10-12-22)8-6-16-14-18(4-5-20(16)25-21)24-19-7-13-23-15-19/h4-5,14,17,19H,1-3,6-13,15H2/t19-/m0/s1 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| 15 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Cephalon, Inc.
Curated by ChEMBL
| Assay Description
Binding affinity to human histamine H3 receptor |
Bioorg Med Chem Lett 22: 186-9 (2011)
Article DOI: 10.1016/j.bmcl.2011.11.038
BindingDB Entry DOI: 10.7270/Q2NS0VB8 |
More data for this
Ligand-Target Pair | |
Histamine H3 receptor
(Homo sapiens (Human)) | BDBM50360975
(CHEMBL1935421)Show InChI InChI=1S/C22H31NO3/c1-3-18(4-1)23-12-10-22(11-13-23)9-8-17-15-19(6-7-21(17)26-22)25-16-20-5-2-14-24-20/h6-7,15,18,20H,1-5,8-14,16H2 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| 16 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Cephalon, Inc.
Curated by ChEMBL
| Assay Description
Binding affinity to human histamine H3 receptor |
Bioorg Med Chem Lett 22: 186-9 (2011)
Article DOI: 10.1016/j.bmcl.2011.11.038
BindingDB Entry DOI: 10.7270/Q2NS0VB8 |
More data for this
Ligand-Target Pair | |
Histamine H3 receptor
(Homo sapiens (Human)) | BDBM50360992
(CHEMBL1935419)Show InChI InChI=1S/C21H29NO2S/c1-2-17(3-1)22-11-9-21(10-12-22)8-6-16-14-18(4-5-20(16)24-21)23-19-7-13-25-15-19/h4-5,14,17,19H,1-3,6-13,15H2 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| 17 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Cephalon, Inc.
Curated by ChEMBL
| Assay Description
Binding affinity to human histamine H3 receptor |
Bioorg Med Chem Lett 22: 186-9 (2011)
Article DOI: 10.1016/j.bmcl.2011.11.038
BindingDB Entry DOI: 10.7270/Q2NS0VB8 |
More data for this
Ligand-Target Pair | |
Histamine H3 receptor
(Homo sapiens (Human)) | BDBM50360993
(CHEMBL1935420)Show InChI InChI=1S/C22H31NO3/c1-2-19(3-1)23-11-9-22(10-12-23)8-6-18-14-20(4-5-21(18)26-22)25-16-17-7-13-24-15-17/h4-5,14,17,19H,1-3,6-13,15-16H2 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| 18 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Cephalon, Inc.
Curated by ChEMBL
| Assay Description
Binding affinity to human histamine H3 receptor |
Bioorg Med Chem Lett 22: 186-9 (2011)
Article DOI: 10.1016/j.bmcl.2011.11.038
BindingDB Entry DOI: 10.7270/Q2NS0VB8 |
More data for this
Ligand-Target Pair | |
Histamine H3 receptor
(Homo sapiens (Human)) | BDBM50360984
(CHEMBL1935411)Show InChI InChI=1S/C21H31NO3/c1-20(2,23)15-24-18-6-7-19-16(14-18)8-9-21(25-19)10-12-22(13-11-21)17-4-3-5-17/h6-7,14,17,23H,3-5,8-13,15H2,1-2H3 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 18 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Cephalon, Inc.
Curated by ChEMBL
| Assay Description
Binding affinity to human histamine H3 receptor |
Bioorg Med Chem Lett 22: 186-9 (2011)
Article DOI: 10.1016/j.bmcl.2011.11.038
BindingDB Entry DOI: 10.7270/Q2NS0VB8 |
More data for this
Ligand-Target Pair | |
Histamine H3 receptor
(Homo sapiens (Human)) | BDBM50360979
(CHEMBL1935424)Show SMILES O=S1(=O)CCC(C1)Oc1ccc2OC3(CCN(CC3)C3CCC3)CCc2c1 Show InChI InChI=1S/C21H29NO4S/c23-27(24)13-7-19(15-27)25-18-4-5-20-16(14-18)6-8-21(26-20)9-11-22(12-10-21)17-2-1-3-17/h4-5,14,17,19H,1-3,6-13,15H2 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| 23 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Cephalon, Inc.
Curated by ChEMBL
| Assay Description
Binding affinity to human histamine H3 receptor |
Bioorg Med Chem Lett 22: 186-9 (2011)
Article DOI: 10.1016/j.bmcl.2011.11.038
BindingDB Entry DOI: 10.7270/Q2NS0VB8 |
More data for this
Ligand-Target Pair | |
Histamine H3 receptor
(Homo sapiens (Human)) | BDBM50360977
(CHEMBL1935422)Show InChI InChI=1S/C22H31NO2S/c1-2-18(3-1)23-12-10-22(11-13-23)9-6-17-16-20(4-5-21(17)25-22)24-19-7-14-26-15-8-19/h4-5,16,18-19H,1-3,6-15H2 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| 23 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Cephalon, Inc.
Curated by ChEMBL
| Assay Description
Binding affinity to human histamine H3 receptor |
Bioorg Med Chem Lett 22: 186-9 (2011)
Article DOI: 10.1016/j.bmcl.2011.11.038
BindingDB Entry DOI: 10.7270/Q2NS0VB8 |
More data for this
Ligand-Target Pair | |
Histamine H3 receptor
(Rattus norvegicus (rat)) | BDBM50360973
(CHEMBL1935425)Show SMILES O=S1(=O)CCC(CC1)Oc1ccc2OC3(CCN(CC3)C3CCC3)CCc2c1 Show InChI InChI=1S/C22H31NO4S/c24-28(25)14-7-19(8-15-28)26-20-4-5-21-17(16-20)6-9-22(27-21)10-12-23(13-11-22)18-2-1-3-18/h4-5,16,18-19H,1-3,6-15H2 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| 24 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Cephalon, Inc.
Curated by ChEMBL
| Assay Description
Binding affinity to rat histamine H3 receptor |
Bioorg Med Chem Lett 22: 186-9 (2011)
Article DOI: 10.1016/j.bmcl.2011.11.038
BindingDB Entry DOI: 10.7270/Q2NS0VB8 |
More data for this
Ligand-Target Pair | |
Histamine H3 receptor
(Homo sapiens (Human)) | BDBM50360981
(CHEMBL1935408)Show InChI InChI=1S/C20H29NO3/c1-15(22)14-23-18-5-6-19-16(13-18)7-8-20(24-19)9-11-21(12-10-20)17-3-2-4-17/h5-6,13,15,17,22H,2-4,7-12,14H2,1H3 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 25 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Cephalon, Inc.
Curated by ChEMBL
| Assay Description
Binding affinity to human histamine H3 receptor |
Bioorg Med Chem Lett 22: 186-9 (2011)
Article DOI: 10.1016/j.bmcl.2011.11.038
BindingDB Entry DOI: 10.7270/Q2NS0VB8 |
More data for this
Ligand-Target Pair | |
Histamine H3 receptor
(Homo sapiens (Human)) | BDBM50360983
(CHEMBL1935410)Show SMILES CC[C@H](O)COc1ccc2OC3(CCN(CC3)C3CCC3)CCc2c1 |r| Show InChI InChI=1S/C21H31NO3/c1-2-18(23)15-24-19-6-7-20-16(14-19)8-9-21(25-20)10-12-22(13-11-21)17-4-3-5-17/h6-7,14,17-18,23H,2-5,8-13,15H2,1H3/t18-/m0/s1 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 26 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Cephalon, Inc.
Curated by ChEMBL
| Assay Description
Binding affinity to human histamine H3 receptor |
Bioorg Med Chem Lett 22: 186-9 (2011)
Article DOI: 10.1016/j.bmcl.2011.11.038
BindingDB Entry DOI: 10.7270/Q2NS0VB8 |
More data for this
Ligand-Target Pair | |
Histamine H3 receptor
(Homo sapiens (Human)) | BDBM50360990
(CHEMBL1935417)Show SMILES C1CC(C1)N1CCC2(CC1)CCc1cc(O[C@@H]3CCOC3)ccc1O2 |r| Show InChI InChI=1S/C21H29NO3/c1-2-17(3-1)22-11-9-21(10-12-22)8-6-16-14-18(4-5-20(16)25-21)24-19-7-13-23-15-19/h4-5,14,17,19H,1-3,6-13,15H2/t19-/m1/s1 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| 27 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Cephalon, Inc.
Curated by ChEMBL
| Assay Description
Binding affinity to human histamine H3 receptor |
Bioorg Med Chem Lett 22: 186-9 (2011)
Article DOI: 10.1016/j.bmcl.2011.11.038
BindingDB Entry DOI: 10.7270/Q2NS0VB8 |
More data for this
Ligand-Target Pair | |
Histamine H3 receptor
(Homo sapiens (Human)) | BDBM50360986
(CHEMBL1935413)Show InChI InChI=1S/C20H29NO2S/c1-24-14-13-22-18-5-6-19-16(15-18)7-8-20(23-19)9-11-21(12-10-20)17-3-2-4-17/h5-6,15,17H,2-4,7-14H2,1H3 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 38 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Cephalon, Inc.
Curated by ChEMBL
| Assay Description
Binding affinity to human histamine H3 receptor |
Bioorg Med Chem Lett 22: 186-9 (2011)
Article DOI: 10.1016/j.bmcl.2011.11.038
BindingDB Entry DOI: 10.7270/Q2NS0VB8 |
More data for this
Ligand-Target Pair | |
Histamine H3 receptor
(Rattus norvegicus (rat)) | BDBM50360991
(CHEMBL1935418)Show SMILES C1CC(C1)N1CCC2(CC1)CCc1cc(O[C@H]3CCOC3)ccc1O2 |r| Show InChI InChI=1S/C21H29NO3/c1-2-17(3-1)22-11-9-21(10-12-22)8-6-16-14-18(4-5-20(16)25-21)24-19-7-13-23-15-19/h4-5,14,17,19H,1-3,6-13,15H2/t19-/m0/s1 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| 39 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Cephalon, Inc.
Curated by ChEMBL
| Assay Description
Binding affinity to rat histamine H3 receptor |
Bioorg Med Chem Lett 22: 186-9 (2011)
Article DOI: 10.1016/j.bmcl.2011.11.038
BindingDB Entry DOI: 10.7270/Q2NS0VB8 |
More data for this
Ligand-Target Pair | |
Histamine H3 receptor
(Homo sapiens (Human)) | BDBM50360988
(CHEMBL1935415)Show SMILES CS(=O)(=O)CCOc1ccc2OC3(CCN(CC3)C3CCC3)CCc2c1 Show InChI InChI=1S/C20H29NO4S/c1-26(22,23)14-13-24-18-5-6-19-16(15-18)7-8-20(25-19)9-11-21(12-10-20)17-3-2-4-17/h5-6,15,17H,2-4,7-14H2,1H3 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 39 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Cephalon, Inc.
Curated by ChEMBL
| Assay Description
Binding affinity to human histamine H3 receptor |
Bioorg Med Chem Lett 22: 186-9 (2011)
Article DOI: 10.1016/j.bmcl.2011.11.038
BindingDB Entry DOI: 10.7270/Q2NS0VB8 |
More data for this
Ligand-Target Pair | |
Histamine H3 receptor
(Rattus norvegicus (rat)) | BDBM50360989
(CHEMBL1935416)Show SMILES CS(=O)(=O)CCCOc1ccc2OC3(CCN(CC3)C3CCC3)CCc2c1 Show InChI InChI=1S/C21H31NO4S/c1-27(23,24)15-3-14-25-19-6-7-20-17(16-19)8-9-21(26-20)10-12-22(13-11-21)18-4-2-5-18/h6-7,16,18H,2-5,8-15H2,1H3 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 41 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Cephalon, Inc.
Curated by ChEMBL
| Assay Description
Binding affinity to rat histamine H3 receptor |
Bioorg Med Chem Lett 22: 186-9 (2011)
Article DOI: 10.1016/j.bmcl.2011.11.038
BindingDB Entry DOI: 10.7270/Q2NS0VB8 |
More data for this
Ligand-Target Pair | |
Histamine H3 receptor
(Rattus norvegicus (rat)) | BDBM50360992
(CHEMBL1935419)Show InChI InChI=1S/C21H29NO2S/c1-2-17(3-1)22-11-9-21(10-12-22)8-6-16-14-18(4-5-20(16)24-21)23-19-7-13-25-15-19/h4-5,14,17,19H,1-3,6-13,15H2 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| 42 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Cephalon, Inc.
Curated by ChEMBL
| Assay Description
Binding affinity to rat histamine H3 receptor |
Bioorg Med Chem Lett 22: 186-9 (2011)
Article DOI: 10.1016/j.bmcl.2011.11.038
BindingDB Entry DOI: 10.7270/Q2NS0VB8 |
More data for this
Ligand-Target Pair | |
Histamine H3 receptor
(Rattus norvegicus (rat)) | BDBM50360976
(CHEMBL1933091)Show InChI InChI=1S/C22H31NO3/c1-2-18(3-1)23-12-10-22(11-13-23)9-6-17-16-20(4-5-21(17)26-22)25-19-7-14-24-15-8-19/h4-5,16,18-19H,1-3,6-15H2 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| 42 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Cephalon, Inc.
Curated by ChEMBL
| Assay Description
Binding affinity to rat histamine H3 receptor |
Bioorg Med Chem Lett 22: 186-9 (2011)
Article DOI: 10.1016/j.bmcl.2011.11.038
BindingDB Entry DOI: 10.7270/Q2NS0VB8 |
More data for this
Ligand-Target Pair | |
Histamine H3 receptor
(Homo sapiens (Human)) | BDBM50360985
(CHEMBL1935412)Show InChI InChI=1S/C20H29NO3/c1-22-13-14-23-18-5-6-19-16(15-18)7-8-20(24-19)9-11-21(12-10-20)17-3-2-4-17/h5-6,15,17H,2-4,7-14H2,1H3 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 42 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Cephalon, Inc.
Curated by ChEMBL
| Assay Description
Binding affinity to human histamine H3 receptor |
Bioorg Med Chem Lett 22: 186-9 (2011)
Article DOI: 10.1016/j.bmcl.2011.11.038
BindingDB Entry DOI: 10.7270/Q2NS0VB8 |
More data for this
Ligand-Target Pair | |
Histamine H3 receptor
(Rattus norvegicus (rat)) | BDBM50360979
(CHEMBL1935424)Show SMILES O=S1(=O)CCC(C1)Oc1ccc2OC3(CCN(CC3)C3CCC3)CCc2c1 Show InChI InChI=1S/C21H29NO4S/c23-27(24)13-7-19(15-27)25-18-4-5-20-16(14-18)6-8-21(26-20)9-11-22(12-10-21)17-2-1-3-17/h4-5,14,17,19H,1-3,6-13,15H2 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| 44 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Cephalon, Inc.
Curated by ChEMBL
| Assay Description
Binding affinity to rat histamine H3 receptor |
Bioorg Med Chem Lett 22: 186-9 (2011)
Article DOI: 10.1016/j.bmcl.2011.11.038
BindingDB Entry DOI: 10.7270/Q2NS0VB8 |
More data for this
Ligand-Target Pair | |
Histamine H3 receptor
(Rattus norvegicus (rat)) | BDBM50360978
(CHEMBL1935423)Show SMILES C(Oc1ccc2OC3(CCN(CC3)C3CCC3)CCc2c1)C1CCSCC1 Show InChI InChI=1S/C23H33NO2S/c1-2-20(3-1)24-12-10-23(11-13-24)9-6-19-16-21(4-5-22(19)26-23)25-17-18-7-14-27-15-8-18/h4-5,16,18,20H,1-3,6-15,17H2 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| 48 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Cephalon, Inc.
Curated by ChEMBL
| Assay Description
Binding affinity to rat histamine H3 receptor |
Bioorg Med Chem Lett 22: 186-9 (2011)
Article DOI: 10.1016/j.bmcl.2011.11.038
BindingDB Entry DOI: 10.7270/Q2NS0VB8 |
More data for this
Ligand-Target Pair | |
Histamine H3 receptor
(Rattus norvegicus (rat)) | BDBM50360993
(CHEMBL1935420)Show InChI InChI=1S/C22H31NO3/c1-2-19(3-1)23-11-9-22(10-12-23)8-6-18-14-20(4-5-21(18)26-22)25-16-17-7-13-24-15-17/h4-5,14,17,19H,1-3,6-13,15-16H2 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| 49 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Cephalon, Inc.
Curated by ChEMBL
| Assay Description
Binding affinity to rat histamine H3 receptor |
Bioorg Med Chem Lett 22: 186-9 (2011)
Article DOI: 10.1016/j.bmcl.2011.11.038
BindingDB Entry DOI: 10.7270/Q2NS0VB8 |
More data for this
Ligand-Target Pair | |
Histamine H3 receptor
(Rattus norvegicus (rat)) | BDBM50360975
(CHEMBL1935421)Show InChI InChI=1S/C22H31NO3/c1-3-18(4-1)23-12-10-22(11-13-23)9-8-17-15-19(6-7-21(17)26-22)25-16-20-5-2-14-24-20/h6-7,15,18,20H,1-5,8-14,16H2 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| 50 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Cephalon, Inc.
Curated by ChEMBL
| Assay Description
Binding affinity to rat histamine H3 receptor |
Bioorg Med Chem Lett 22: 186-9 (2011)
Article DOI: 10.1016/j.bmcl.2011.11.038
BindingDB Entry DOI: 10.7270/Q2NS0VB8 |
More data for this
Ligand-Target Pair | |
Histamine H3 receptor
(Rattus norvegicus (rat)) | BDBM50360977
(CHEMBL1935422)Show InChI InChI=1S/C22H31NO2S/c1-2-18(3-1)23-12-10-22(11-13-23)9-6-17-16-20(4-5-21(17)25-22)24-19-7-14-26-15-8-19/h4-5,16,18-19H,1-3,6-15H2 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| 62 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Cephalon, Inc.
Curated by ChEMBL
| Assay Description
Binding affinity to rat histamine H3 receptor |
Bioorg Med Chem Lett 22: 186-9 (2011)
Article DOI: 10.1016/j.bmcl.2011.11.038
BindingDB Entry DOI: 10.7270/Q2NS0VB8 |
More data for this
Ligand-Target Pair | |
Histamine H3 receptor
(Rattus norvegicus (rat)) | BDBM50360987
(CHEMBL1935414)Show InChI InChI=1S/C21H31NO2S/c1-25-15-3-14-23-19-6-7-20-17(16-19)8-9-21(24-20)10-12-22(13-11-21)18-4-2-5-18/h6-7,16,18H,2-5,8-15H2,1H3 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 64 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Cephalon, Inc.
Curated by ChEMBL
| Assay Description
Binding affinity to rat histamine H3 receptor |
Bioorg Med Chem Lett 22: 186-9 (2011)
Article DOI: 10.1016/j.bmcl.2011.11.038
BindingDB Entry DOI: 10.7270/Q2NS0VB8 |
More data for this
Ligand-Target Pair | |
Histamine H3 receptor
(Rattus norvegicus (rat)) | BDBM50360984
(CHEMBL1935411)Show InChI InChI=1S/C21H31NO3/c1-20(2,23)15-24-18-6-7-19-16(14-18)8-9-21(25-19)10-12-22(13-11-21)17-4-3-5-17/h6-7,14,17,23H,3-5,8-13,15H2,1-2H3 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 74 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Cephalon, Inc.
Curated by ChEMBL
| Assay Description
Binding affinity to rat histamine H3 receptor |
Bioorg Med Chem Lett 22: 186-9 (2011)
Article DOI: 10.1016/j.bmcl.2011.11.038
BindingDB Entry DOI: 10.7270/Q2NS0VB8 |
More data for this
Ligand-Target Pair | |
Histamine H3 receptor
(Rattus norvegicus (rat)) | BDBM50360982
(CHEMBL1935409)Show SMILES CC[C@@H](O)COc1ccc2OC3(CCN(CC3)C3CCC3)CCc2c1 |r| Show InChI InChI=1S/C21H31NO3/c1-2-18(23)15-24-19-6-7-20-16(14-19)8-9-21(25-20)10-12-22(13-11-21)17-4-3-5-17/h6-7,14,17-18,23H,2-5,8-13,15H2,1H3/t18-/m1/s1 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 86 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Cephalon, Inc.
Curated by ChEMBL
| Assay Description
Binding affinity to rat histamine H3 receptor |
Bioorg Med Chem Lett 22: 186-9 (2011)
Article DOI: 10.1016/j.bmcl.2011.11.038
BindingDB Entry DOI: 10.7270/Q2NS0VB8 |
More data for this
Ligand-Target Pair | |
Histamine H3 receptor
(Rattus norvegicus (rat)) | BDBM50360986
(CHEMBL1935413)Show InChI InChI=1S/C20H29NO2S/c1-24-14-13-22-18-5-6-19-16(15-18)7-8-20(23-19)9-11-21(12-10-20)17-3-2-4-17/h5-6,15,17H,2-4,7-14H2,1H3 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 86 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Cephalon, Inc.
Curated by ChEMBL
| Assay Description
Binding affinity to rat histamine H3 receptor |
Bioorg Med Chem Lett 22: 186-9 (2011)
Article DOI: 10.1016/j.bmcl.2011.11.038
BindingDB Entry DOI: 10.7270/Q2NS0VB8 |
More data for this
Ligand-Target Pair | |
Histamine H3 receptor
(Rattus norvegicus (rat)) | BDBM50360985
(CHEMBL1935412)Show InChI InChI=1S/C20H29NO3/c1-22-13-14-23-18-5-6-19-16(15-18)7-8-20(24-19)9-11-21(12-10-20)17-3-2-4-17/h5-6,15,17H,2-4,7-14H2,1H3 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 91 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Cephalon, Inc.
Curated by ChEMBL
| Assay Description
Binding affinity to rat histamine H3 receptor |
Bioorg Med Chem Lett 22: 186-9 (2011)
Article DOI: 10.1016/j.bmcl.2011.11.038
BindingDB Entry DOI: 10.7270/Q2NS0VB8 |
More data for this
Ligand-Target Pair | |
Histamine H3 receptor
(Rattus norvegicus (rat)) | BDBM50360981
(CHEMBL1935408)Show InChI InChI=1S/C20H29NO3/c1-15(22)14-23-18-5-6-19-16(13-18)7-8-20(24-19)9-11-21(12-10-20)17-3-2-4-17/h5-6,13,15,17,22H,2-4,7-12,14H2,1H3 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 99 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Cephalon, Inc.
Curated by ChEMBL
| Assay Description
Binding affinity to rat histamine H3 receptor |
Bioorg Med Chem Lett 22: 186-9 (2011)
Article DOI: 10.1016/j.bmcl.2011.11.038
BindingDB Entry DOI: 10.7270/Q2NS0VB8 |
More data for this
Ligand-Target Pair | |
Histamine H3 receptor
(Rattus norvegicus (rat)) | BDBM50360983
(CHEMBL1935410)Show SMILES CC[C@H](O)COc1ccc2OC3(CCN(CC3)C3CCC3)CCc2c1 |r| Show InChI InChI=1S/C21H31NO3/c1-2-18(23)15-24-19-6-7-20-16(14-19)8-9-21(25-20)10-12-22(13-11-21)17-4-3-5-17/h6-7,14,17-18,23H,2-5,8-13,15H2,1H3/t18-/m0/s1 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 112 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Cephalon, Inc.
Curated by ChEMBL
| Assay Description
Binding affinity to rat histamine H3 receptor |
Bioorg Med Chem Lett 22: 186-9 (2011)
Article DOI: 10.1016/j.bmcl.2011.11.038
BindingDB Entry DOI: 10.7270/Q2NS0VB8 |
More data for this
Ligand-Target Pair | |
Histamine H3 receptor
(Rattus norvegicus (rat)) | BDBM50360990
(CHEMBL1935417)Show SMILES C1CC(C1)N1CCC2(CC1)CCc1cc(O[C@@H]3CCOC3)ccc1O2 |r| Show InChI InChI=1S/C21H29NO3/c1-2-17(3-1)22-11-9-21(10-12-22)8-6-16-14-18(4-5-20(16)25-21)24-19-7-13-23-15-19/h4-5,14,17,19H,1-3,6-13,15H2/t19-/m1/s1 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| 119 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Cephalon, Inc.
Curated by ChEMBL
| Assay Description
Binding affinity to rat histamine H3 receptor |
Bioorg Med Chem Lett 22: 186-9 (2011)
Article DOI: 10.1016/j.bmcl.2011.11.038
BindingDB Entry DOI: 10.7270/Q2NS0VB8 |
More data for this
Ligand-Target Pair | |
Histamine H3 receptor
(Homo sapiens (Human)) | BDBM50360980
(CHEMBL1935407)Show InChI InChI=1S/C19H27NO3/c21-12-13-22-17-4-5-18-15(14-17)6-7-19(23-18)8-10-20(11-9-19)16-2-1-3-16/h4-5,14,16,21H,1-3,6-13H2 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 126 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Cephalon, Inc.
Curated by ChEMBL
| Assay Description
Binding affinity to human histamine H3 receptor |
Bioorg Med Chem Lett 22: 186-9 (2011)
Article DOI: 10.1016/j.bmcl.2011.11.038
BindingDB Entry DOI: 10.7270/Q2NS0VB8 |
More data for this
Ligand-Target Pair | |
Histamine H3 receptor
(Rattus norvegicus (rat)) | BDBM50360988
(CHEMBL1935415)Show SMILES CS(=O)(=O)CCOc1ccc2OC3(CCN(CC3)C3CCC3)CCc2c1 Show InChI InChI=1S/C20H29NO4S/c1-26(22,23)14-13-24-18-5-6-19-16(15-18)7-8-20(25-19)9-11-21(12-10-20)17-3-2-4-17/h5-6,15,17H,2-4,7-14H2,1H3 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 157 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Cephalon, Inc.
Curated by ChEMBL
| Assay Description
Binding affinity to rat histamine H3 receptor |
Bioorg Med Chem Lett 22: 186-9 (2011)
Article DOI: 10.1016/j.bmcl.2011.11.038
BindingDB Entry DOI: 10.7270/Q2NS0VB8 |
More data for this
Ligand-Target Pair | |
Histamine H3 receptor
(Rattus norvegicus (rat)) | BDBM50360980
(CHEMBL1935407)Show InChI InChI=1S/C19H27NO3/c21-12-13-22-17-4-5-18-15(14-17)6-7-19(23-18)8-10-20(11-9-19)16-2-1-3-16/h4-5,14,16,21H,1-3,6-13H2 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 368 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Cephalon, Inc.
Curated by ChEMBL
| Assay Description
Binding affinity to rat histamine H3 receptor |
Bioorg Med Chem Lett 22: 186-9 (2011)
Article DOI: 10.1016/j.bmcl.2011.11.038
BindingDB Entry DOI: 10.7270/Q2NS0VB8 |
More data for this
Ligand-Target Pair | |
Histamine H4 receptor
(Homo sapiens (Human)) | BDBM50360989
(CHEMBL1935416)Show SMILES CS(=O)(=O)CCCOc1ccc2OC3(CCN(CC3)C3CCC3)CCc2c1 Show InChI InChI=1S/C21H31NO4S/c1-27(23,24)15-3-14-25-19-6-7-20-17(16-19)8-9-21(26-20)10-12-22(13-11-21)18-4-2-5-18/h6-7,16,18H,2-5,8-15H2,1H3 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| >1.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Cephalon, Inc.
Curated by ChEMBL
| Assay Description
Binding affinity to human histamine H4 receptor |
Bioorg Med Chem Lett 22: 186-9 (2011)
Article DOI: 10.1016/j.bmcl.2011.11.038
BindingDB Entry DOI: 10.7270/Q2NS0VB8 |
More data for this
Ligand-Target Pair | |
Histamine H1 receptor
(Homo sapiens (Human)) | BDBM50360974
(CHEMBL1935426)Show SMILES O=S1(=O)CCC(COc2ccc3OC4(CCN(CC4)C4CCC4)CCc3c2)CC1 Show InChI InChI=1S/C23H33NO4S/c25-29(26)14-7-18(8-15-29)17-27-21-4-5-22-19(16-21)6-9-23(28-22)10-12-24(13-11-23)20-2-1-3-20/h4-5,16,18,20H,1-3,6-15,17H2 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| >1.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Cephalon, Inc.
Curated by ChEMBL
| Assay Description
Binding affinity to human histamine H1 receptor |
Bioorg Med Chem Lett 22: 186-9 (2011)
Article DOI: 10.1016/j.bmcl.2011.11.038
BindingDB Entry DOI: 10.7270/Q2NS0VB8 |
More data for this
Ligand-Target Pair | |
Histamine H1 receptor
(Homo sapiens (Human)) | BDBM50360973
(CHEMBL1935425)Show SMILES O=S1(=O)CCC(CC1)Oc1ccc2OC3(CCN(CC3)C3CCC3)CCc2c1 Show InChI InChI=1S/C22H31NO4S/c24-28(25)14-7-19(8-15-28)26-20-4-5-21-17(16-20)6-9-22(27-21)10-12-23(13-11-22)18-2-1-3-18/h4-5,16,18-19H,1-3,6-15H2 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| >1.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Cephalon, Inc.
Curated by ChEMBL
| Assay Description
Binding affinity to human histamine H1 receptor |
Bioorg Med Chem Lett 22: 186-9 (2011)
Article DOI: 10.1016/j.bmcl.2011.11.038
BindingDB Entry DOI: 10.7270/Q2NS0VB8 |
More data for this
Ligand-Target Pair | |
Histamine H2 receptor
(Homo sapiens (Human)) | BDBM50360974
(CHEMBL1935426)Show SMILES O=S1(=O)CCC(COc2ccc3OC4(CCN(CC4)C4CCC4)CCc3c2)CC1 Show InChI InChI=1S/C23H33NO4S/c25-29(26)14-7-18(8-15-29)17-27-21-4-5-22-19(16-21)6-9-23(28-22)10-12-24(13-11-23)20-2-1-3-20/h4-5,16,18,20H,1-3,6-15,17H2 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| >1.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Cephalon, Inc.
Curated by ChEMBL
| Assay Description
Binding affinity to human histamine H2 receptor |
Bioorg Med Chem Lett 22: 186-9 (2011)
Article DOI: 10.1016/j.bmcl.2011.11.038
BindingDB Entry DOI: 10.7270/Q2NS0VB8 |
More data for this
Ligand-Target Pair | |
Histamine H4 receptor
(Homo sapiens (Human)) | BDBM50360974
(CHEMBL1935426)Show SMILES O=S1(=O)CCC(COc2ccc3OC4(CCN(CC4)C4CCC4)CCc3c2)CC1 Show InChI InChI=1S/C23H33NO4S/c25-29(26)14-7-18(8-15-29)17-27-21-4-5-22-19(16-21)6-9-23(28-22)10-12-24(13-11-23)20-2-1-3-20/h4-5,16,18,20H,1-3,6-15,17H2 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| >1.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Cephalon, Inc.
Curated by ChEMBL
| Assay Description
Binding affinity to human histamine H4 receptor |
Bioorg Med Chem Lett 22: 186-9 (2011)
Article DOI: 10.1016/j.bmcl.2011.11.038
BindingDB Entry DOI: 10.7270/Q2NS0VB8 |
More data for this
Ligand-Target Pair | |
Histamine H1 receptor
(Homo sapiens (Human)) | BDBM50360989
(CHEMBL1935416)Show SMILES CS(=O)(=O)CCCOc1ccc2OC3(CCN(CC3)C3CCC3)CCc2c1 Show InChI InChI=1S/C21H31NO4S/c1-27(23,24)15-3-14-25-19-6-7-20-17(16-19)8-9-21(26-20)10-12-22(13-11-21)18-4-2-5-18/h6-7,16,18H,2-5,8-15H2,1H3 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| >1.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Cephalon, Inc.
Curated by ChEMBL
| Assay Description
Binding affinity to human histamine H1 receptor |
Bioorg Med Chem Lett 22: 186-9 (2011)
Article DOI: 10.1016/j.bmcl.2011.11.038
BindingDB Entry DOI: 10.7270/Q2NS0VB8 |
More data for this
Ligand-Target Pair | |
Histamine H2 receptor
(Homo sapiens (Human)) | BDBM50360973
(CHEMBL1935425)Show SMILES O=S1(=O)CCC(CC1)Oc1ccc2OC3(CCN(CC3)C3CCC3)CCc2c1 Show InChI InChI=1S/C22H31NO4S/c24-28(25)14-7-19(8-15-28)26-20-4-5-21-17(16-20)6-9-22(27-21)10-12-23(13-11-22)18-2-1-3-18/h4-5,16,18-19H,1-3,6-15H2 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| >1.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Cephalon, Inc.
Curated by ChEMBL
| Assay Description
Binding affinity to human histamine H2 receptor |
Bioorg Med Chem Lett 22: 186-9 (2011)
Article DOI: 10.1016/j.bmcl.2011.11.038
BindingDB Entry DOI: 10.7270/Q2NS0VB8 |
More data for this
Ligand-Target Pair | |
Histamine H4 receptor
(Homo sapiens (Human)) | BDBM50360973
(CHEMBL1935425)Show SMILES O=S1(=O)CCC(CC1)Oc1ccc2OC3(CCN(CC3)C3CCC3)CCc2c1 Show InChI InChI=1S/C22H31NO4S/c24-28(25)14-7-19(8-15-28)26-20-4-5-21-17(16-20)6-9-22(27-21)10-12-23(13-11-22)18-2-1-3-18/h4-5,16,18-19H,1-3,6-15H2 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| >1.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Cephalon, Inc.
Curated by ChEMBL
| Assay Description
Binding affinity to human histamine H4 receptor |
Bioorg Med Chem Lett 22: 186-9 (2011)
Article DOI: 10.1016/j.bmcl.2011.11.038
BindingDB Entry DOI: 10.7270/Q2NS0VB8 |
More data for this
Ligand-Target Pair | |
Histamine H2 receptor
(Homo sapiens (Human)) | BDBM50360989
(CHEMBL1935416)Show SMILES CS(=O)(=O)CCCOc1ccc2OC3(CCN(CC3)C3CCC3)CCc2c1 Show InChI InChI=1S/C21H31NO4S/c1-27(23,24)15-3-14-25-19-6-7-20-17(16-19)8-9-21(26-20)10-12-22(13-11-21)18-4-2-5-18/h6-7,16,18H,2-5,8-15H2,1H3 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| >1.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Cephalon, Inc.
Curated by ChEMBL
| Assay Description
Binding affinity to human histamine H2 receptor |
Bioorg Med Chem Lett 22: 186-9 (2011)
Article DOI: 10.1016/j.bmcl.2011.11.038
BindingDB Entry DOI: 10.7270/Q2NS0VB8 |
More data for this
Ligand-Target Pair | |
Cytochrome P450 2D6
(Homo sapiens (Human)) | BDBM50360973
(CHEMBL1935425)Show SMILES O=S1(=O)CCC(CC1)Oc1ccc2OC3(CCN(CC3)C3CCC3)CCc2c1 Show InChI InChI=1S/C22H31NO4S/c24-28(25)14-7-19(8-15-28)26-20-4-5-21-17(16-20)6-9-22(27-21)10-12-23(13-11-22)18-2-1-3-18/h4-5,16,18-19H,1-3,6-15H2 | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 6.60E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Cephalon, Inc.
Curated by ChEMBL
| Assay Description
Inhibition of CYP2D6 |
Bioorg Med Chem Lett 22: 186-9 (2011)
Article DOI: 10.1016/j.bmcl.2011.11.038
BindingDB Entry DOI: 10.7270/Q2NS0VB8 |
More data for this
Ligand-Target Pair | |
Potassium voltage-gated channel subfamily H member 2
(Homo sapiens (Human)) | BDBM50360973
(CHEMBL1935425)Show SMILES O=S1(=O)CCC(CC1)Oc1ccc2OC3(CCN(CC3)C3CCC3)CCc2c1 Show InChI InChI=1S/C22H31NO4S/c24-28(25)14-7-19(8-15-28)26-20-4-5-21-17(16-20)6-9-22(27-21)10-12-23(13-11-22)18-2-1-3-18/h4-5,16,18-19H,1-3,6-15H2 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
UniProtKB/TrEMBL
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 7.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Cephalon, Inc.
Curated by ChEMBL
| Assay Description
Inhibition of human Erg |
Bioorg Med Chem Lett 22: 186-9 (2011)
Article DOI: 10.1016/j.bmcl.2011.11.038
BindingDB Entry DOI: 10.7270/Q2NS0VB8 |
More data for this
Ligand-Target Pair | |
Cytochrome P450 2D6
(Homo sapiens (Human)) | BDBM50360974
(CHEMBL1935426)Show SMILES O=S1(=O)CCC(COc2ccc3OC4(CCN(CC4)C4CCC4)CCc3c2)CC1 Show InChI InChI=1S/C23H33NO4S/c25-29(26)14-7-18(8-15-29)17-27-21-4-5-22-19(16-21)6-9-23(28-22)10-12-24(13-11-23)20-2-1-3-20/h4-5,16,18,20H,1-3,6-15,17H2 | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 1.10E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Cephalon, Inc.
Curated by ChEMBL
| Assay Description
Inhibition of CYP2D6 |
Bioorg Med Chem Lett 22: 186-9 (2011)
Article DOI: 10.1016/j.bmcl.2011.11.038
BindingDB Entry DOI: 10.7270/Q2NS0VB8 |
More data for this
Ligand-Target Pair | |
Potassium voltage-gated channel subfamily H member 2
(Homo sapiens (Human)) | BDBM50360974
(CHEMBL1935426)Show SMILES O=S1(=O)CCC(COc2ccc3OC4(CCN(CC4)C4CCC4)CCc3c2)CC1 Show InChI InChI=1S/C23H33NO4S/c25-29(26)14-7-18(8-15-29)17-27-21-4-5-22-19(16-21)6-9-23(28-22)10-12-24(13-11-23)20-2-1-3-20/h4-5,16,18,20H,1-3,6-15,17H2 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
UniProtKB/TrEMBL
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | >3.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Cephalon, Inc.
Curated by ChEMBL
| Assay Description
Inhibition of human Erg |
Bioorg Med Chem Lett 22: 186-9 (2011)
Article DOI: 10.1016/j.bmcl.2011.11.038
BindingDB Entry DOI: 10.7270/Q2NS0VB8 |
More data for this
Ligand-Target Pair | |
Cytochrome P450 2C9
(Homo sapiens (Human)) | BDBM50360989
(CHEMBL1935416)Show SMILES CS(=O)(=O)CCCOc1ccc2OC3(CCN(CC3)C3CCC3)CCc2c1 Show InChI InChI=1S/C21H31NO4S/c1-27(23,24)15-3-14-25-19-6-7-20-17(16-19)8-9-21(26-20)10-12-22(13-11-21)18-4-2-5-18/h6-7,16,18H,2-5,8-15H2,1H3 | 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 | >3.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Cephalon, Inc.
Curated by ChEMBL
| Assay Description
Inhibition of CYP2C9 |
Bioorg Med Chem Lett 22: 186-9 (2011)
Article DOI: 10.1016/j.bmcl.2011.11.038
BindingDB Entry DOI: 10.7270/Q2NS0VB8 |
More data for this
Ligand-Target Pair | |
Cytochrome P450 1A2
(Homo sapiens (Human)) | BDBM50360989
(CHEMBL1935416)Show SMILES CS(=O)(=O)CCCOc1ccc2OC3(CCN(CC3)C3CCC3)CCc2c1 Show InChI InChI=1S/C21H31NO4S/c1-27(23,24)15-3-14-25-19-6-7-20-17(16-19)8-9-21(26-20)10-12-22(13-11-21)18-4-2-5-18/h6-7,16,18H,2-5,8-15H2,1H3 | 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 | >3.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Cephalon, Inc.
Curated by ChEMBL
| Assay Description
Inhibition of CYP1A2 |
Bioorg Med Chem Lett 22: 186-9 (2011)
Article DOI: 10.1016/j.bmcl.2011.11.038
BindingDB Entry DOI: 10.7270/Q2NS0VB8 |
More data for this
Ligand-Target Pair | |
Cytochrome P450 2C19
(Homo sapiens (Human)) | BDBM50360989
(CHEMBL1935416)Show SMILES CS(=O)(=O)CCCOc1ccc2OC3(CCN(CC3)C3CCC3)CCc2c1 Show InChI InChI=1S/C21H31NO4S/c1-27(23,24)15-3-14-25-19-6-7-20-17(16-19)8-9-21(26-20)10-12-22(13-11-21)18-4-2-5-18/h6-7,16,18H,2-5,8-15H2,1H3 | 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 | >3.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Cephalon, Inc.
Curated by ChEMBL
| Assay Description
Inhibition of CYP2C19 |
Bioorg Med Chem Lett 22: 186-9 (2011)
Article DOI: 10.1016/j.bmcl.2011.11.038
BindingDB Entry DOI: 10.7270/Q2NS0VB8 |
More data for this
Ligand-Target Pair | |
Cytochrome P450 3A4
(Homo sapiens (Human)) | BDBM50360989
(CHEMBL1935416)Show SMILES CS(=O)(=O)CCCOc1ccc2OC3(CCN(CC3)C3CCC3)CCc2c1 Show InChI InChI=1S/C21H31NO4S/c1-27(23,24)15-3-14-25-19-6-7-20-17(16-19)8-9-21(26-20)10-12-22(13-11-21)18-4-2-5-18/h6-7,16,18H,2-5,8-15H2,1H3 | 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 | >3.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Cephalon, Inc.
Curated by ChEMBL
| Assay Description
Inhibition of CYP3A4 |
Bioorg Med Chem Lett 22: 186-9 (2011)
Article DOI: 10.1016/j.bmcl.2011.11.038
BindingDB Entry DOI: 10.7270/Q2NS0VB8 |
More data for this
Ligand-Target Pair | |
Cytochrome P450 2D6
(Homo sapiens (Human)) | BDBM50360989
(CHEMBL1935416)Show SMILES CS(=O)(=O)CCCOc1ccc2OC3(CCN(CC3)C3CCC3)CCc2c1 Show InChI InChI=1S/C21H31NO4S/c1-27(23,24)15-3-14-25-19-6-7-20-17(16-19)8-9-21(26-20)10-12-22(13-11-21)18-4-2-5-18/h6-7,16,18H,2-5,8-15H2,1H3 | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | >3.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Cephalon, Inc.
Curated by ChEMBL
| Assay Description
Inhibition of CYP2D6 |
Bioorg Med Chem Lett 22: 186-9 (2011)
Article DOI: 10.1016/j.bmcl.2011.11.038
BindingDB Entry DOI: 10.7270/Q2NS0VB8 |
More data for this
Ligand-Target Pair | |
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