Found 709 hits with Last Name = 'karim' and Initial = 'm' 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
(Homo sapiens (Human)) | BDBM50190927
(CHEMBL214513 | N-((S)-1-((R)-3-(4,4-dimethylcycloh...)Show SMILES CCc1ccc(cc1)-c1ccc(s1)C(=O)N(C)[C@H]1CCN(C1)C(=O)N1CC[C@H](C1)NC1CCC(C)(C)CC1 Show InChI InChI=1S/C31H44N4O2S/c1-5-22-6-8-23(9-7-22)27-10-11-28(38-27)29(36)33(4)26-15-19-35(21-26)30(37)34-18-14-25(20-34)32-24-12-16-31(2,3)17-13-24/h6-11,24-26,32H,5,12-21H2,1-4H3/t25-,26+/m1/s1 | Reactome pathway
KEGG
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet 
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 0.700 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Neurocrine Biosciences Inc.
Curated by ChEMBL
| Assay Description
Binding affinity to MCHR1 by competitive binding assay |
Bioorg Med Chem Lett 16: 4922-30 (2006)
Article DOI: 10.1016/j.bmcl.2006.06.049
BindingDB Entry DOI: 10.7270/Q2TM7BX5 |
More data for this
Ligand-Target Pair | |
Melanin-concentrating hormone receptor 1
(Homo sapiens (Human)) | BDBM50190919
(CHEMBL386454 | N-((S)-1-((R)-3-(4,4-dimethylcycloh...)Show SMILES COc1ccc(cc1)-c1ccc(s1)C(=O)N(C)[C@H]1CCN(C1)C(=O)N1CC[C@H](C1)NC1CCC(C)(C)CC1 Show InChI InChI=1S/C30H42N4O3S/c1-30(2)15-11-22(12-16-30)31-23-13-17-33(19-23)29(36)34-18-14-24(20-34)32(3)28(35)27-10-9-26(38-27)21-5-7-25(37-4)8-6-21/h5-10,22-24,31H,11-20H2,1-4H3/t23-,24+/m1/s1 | Reactome pathway
KEGG
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 0.900 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Neurocrine Biosciences Inc.
Curated by ChEMBL
| Assay Description
Binding affinity to MCHR1 by competitive binding assay |
Bioorg Med Chem Lett 16: 4922-30 (2006)
Article DOI: 10.1016/j.bmcl.2006.06.049
BindingDB Entry DOI: 10.7270/Q2TM7BX5 |
More data for this
Ligand-Target Pair | |
Corticotropin-releasing factor receptor 1
(Homo sapiens (Human)) | BDBM50171332
(1-(2-Bromo-4-isopropyl-phenyl)-7-methyl-5-(1-propy...)Show SMILES CCCC(CCC)N1CCn2c3c1cc(C)nc3n(-c1ccc(cc1Br)C(C)C)c2=O |(-5.8,2.54,;-4.46,3.31,;-3.13,2.54,;-1.79,3.31,;-1.78,4.86,;-.44,5.63,;-.44,7.18,;-.44,2.52,;.9,3.29,;2.23,2.52,;2.22,.97,;.89,.2,;-.44,.97,;-1.78,.19,;-1.78,-1.36,;-3.27,-1.8,;.08,-2.35,;1.22,-1.32,;2.76,-1.46,;3.73,-2.67,;3.16,-4.1,;4.14,-5.31,;5.66,-5.06,;6.2,-3.63,;5.25,-2.44,;5.81,-1.01,;6.41,-6.39,;5.64,-7.72,;7.96,-6.41,;3.37,-.05,;4.89,.27,)| Show InChI InChI=1S/C25H33BrN4O/c1-6-8-19(9-7-2)28-12-13-29-23-22(28)14-17(5)27-24(23)30(25(29)31)21-11-10-18(16(3)4)15-20(21)26/h10-11,14-16,19H,6-9,12-13H2,1-5H3 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 1.10 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Neurocrine Biosciences Inc.
Curated by ChEMBL
| Assay Description
Binding affinity for corticotropin-releasing factor-1 expressed in leukocyte tyrosine kinase cells |
J Med Chem 48: 5104-7 (2005)
Article DOI: 10.1021/jm050384+
BindingDB Entry DOI: 10.7270/Q2610ZVM |
More data for this
Ligand-Target Pair | |
Melanin-concentrating hormone receptor 1
(Homo sapiens (Human)) | BDBM50190948
(CHEMBL442064 | N-((S)-1-((R)-3-(4,4-dimethylcycloh...)Show SMILES CN([C@H]1CCN(C1)C(=O)N1CC[C@H](C1)NC1CCC(C)(C)CC1)C(=O)c1ccc(s1)-c1ccc(C)cc1 Show InChI InChI=1S/C30H42N4O2S/c1-21-5-7-22(8-6-21)26-9-10-27(37-26)28(35)32(4)25-14-18-34(20-25)29(36)33-17-13-24(19-33)31-23-11-15-30(2,3)16-12-23/h5-10,23-25,31H,11-20H2,1-4H3/t24-,25+/m1/s1 | Reactome pathway
KEGG
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 1.60 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Neurocrine Biosciences Inc.
Curated by ChEMBL
| Assay Description
Binding affinity to MCHR1 by competitive binding assay |
Bioorg Med Chem Lett 16: 4922-30 (2006)
Article DOI: 10.1016/j.bmcl.2006.06.049
BindingDB Entry DOI: 10.7270/Q2TM7BX5 |
More data for this
Ligand-Target Pair | |
Melanin-concentrating hormone receptor 1
(Homo sapiens (Human)) | BDBM50190943
(5-(2,3-dihydrobenzo[b][1,4]dioxin-6-yl)-N-((S)-1-(...)Show SMILES CN([C@H]1CCN(C1)C(=O)N1CC[C@H](C1)NC1CCC(C)(C)CC1)C(=O)c1ccc(s1)-c1ccc2OCCOc2c1 Show InChI InChI=1S/C31H42N4O4S/c1-31(2)12-8-22(9-13-31)32-23-10-14-34(19-23)30(37)35-15-11-24(20-35)33(3)29(36)28-7-6-27(40-28)21-4-5-25-26(18-21)39-17-16-38-25/h4-7,18,22-24,32H,8-17,19-20H2,1-3H3/t23-,24+/m1/s1 | Reactome pathway
KEGG
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 1.90 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Neurocrine Biosciences Inc.
Curated by ChEMBL
| Assay Description
Binding affinity to MCHR1 by competitive binding assay |
Bioorg Med Chem Lett 16: 4922-30 (2006)
Article DOI: 10.1016/j.bmcl.2006.06.049
BindingDB Entry DOI: 10.7270/Q2TM7BX5 |
More data for this
Ligand-Target Pair | |
Corticotropin-releasing factor receptor 1
(Homo sapiens (Human)) | BDBM50171318
(1-(4-Methoxy-phenyl)-7-methyl-5-(1-propyl-butyl)-4...)Show SMILES CCCC(CCC)N1CCn2c3c1cc(C)nc3n(-c1ccc(OC)cc1)c2=O Show InChI InChI=1S/C23H30N4O2/c1-5-7-17(8-6-2)25-13-14-26-21-20(25)15-16(3)24-22(21)27(23(26)28)18-9-11-19(29-4)12-10-18/h9-12,15,17H,5-8,13-14H2,1-4H3 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 2 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Neurocrine Biosciences Inc.
Curated by ChEMBL
| Assay Description
Binding affinity for corticotropin-releasing factor-1 expressed in leukocyte tyrosine kinase cells |
J Med Chem 48: 5104-7 (2005)
Article DOI: 10.1021/jm050384+
BindingDB Entry DOI: 10.7270/Q2610ZVM |
More data for this
Ligand-Target Pair | |
Melanin-concentrating hormone receptor 1
(Homo sapiens (Human)) | BDBM50190931
(CHEMBL265255 | N-((S)-1-((R)-3-(cyclopentylamino)p...)Show SMILES CCc1ccc(cc1)-c1ccc(s1)C(=O)N(C)[C@H]1CCN(C1)C(=O)N1CC[C@H](C1)NC1CCCC1 Show InChI InChI=1S/C28H38N4O2S/c1-3-20-8-10-21(11-9-20)25-12-13-26(35-25)27(33)30(2)24-15-17-32(19-24)28(34)31-16-14-23(18-31)29-22-6-4-5-7-22/h8-13,22-24,29H,3-7,14-19H2,1-2H3/t23-,24+/m1/s1 | Reactome pathway
KEGG
UniProtKB/SwissProt
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GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 2 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Neurocrine Biosciences Inc.
Curated by ChEMBL
| Assay Description
Binding affinity to MCHR1 by competitive binding assay |
Bioorg Med Chem Lett 16: 4922-30 (2006)
Article DOI: 10.1016/j.bmcl.2006.06.049
BindingDB Entry DOI: 10.7270/Q2TM7BX5 |
More data for this
Ligand-Target Pair | |
Melanin-concentrating hormone receptor 1
(Homo sapiens (Human)) | BDBM50190922
(5-(4-ethylphenyl)-N-methyl-N-((S)-1-((R)-3-(tetrah...)Show SMILES CCc1ccc(cc1)-c1ccc(s1)C(=O)N(C)[C@H]1CCN(C1)C(=O)N1CC[C@H](C1)NC1CCOCC1 Show InChI InChI=1S/C28H38N4O3S/c1-3-20-4-6-21(7-5-20)25-8-9-26(36-25)27(33)30(2)24-11-15-32(19-24)28(34)31-14-10-23(18-31)29-22-12-16-35-17-13-22/h4-9,22-24,29H,3,10-19H2,1-2H3/t23-,24+/m1/s1 | Reactome pathway
KEGG
UniProtKB/SwissProt
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GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| 2 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Neurocrine Biosciences Inc.
Curated by ChEMBL
| Assay Description
Binding affinity to MCHR1 by competitive binding assay |
Bioorg Med Chem Lett 16: 4922-30 (2006)
Article DOI: 10.1016/j.bmcl.2006.06.049
BindingDB Entry DOI: 10.7270/Q2TM7BX5 |
More data for this
Ligand-Target Pair | |
Melanin-concentrating hormone receptor 1
(Homo sapiens (Human)) | BDBM50190941
(CHEMBL387013 | N-((S)-1-((R)-3-(3-cyclohexylpropyl...)Show SMILES COc1ccc(-c2ccc(s2)C(=O)N(C)[C@H]2CCN(C2)C(=O)N2CC[C@H](C2)NCCCC2CCCCC2)c(C)c1 Show InChI InChI=1S/C32H46N4O3S/c1-23-20-27(39-3)11-12-28(23)29-13-14-30(40-29)31(37)34(2)26-16-19-36(22-26)32(38)35-18-15-25(21-35)33-17-7-10-24-8-5-4-6-9-24/h11-14,20,24-26,33H,4-10,15-19,21-22H2,1-3H3/t25-,26+/m1/s1 | Reactome pathway
KEGG
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 2.20 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Neurocrine Biosciences Inc.
Curated by ChEMBL
| Assay Description
Binding affinity to MCHR1 by competitive binding assay |
Bioorg Med Chem Lett 16: 4922-30 (2006)
Article DOI: 10.1016/j.bmcl.2006.06.049
BindingDB Entry DOI: 10.7270/Q2TM7BX5 |
More data for this
Ligand-Target Pair | |
Melanin-concentrating hormone receptor 1
(Homo sapiens (Human)) | BDBM50190940
(CHEMBL383933 | N-((S)-1-((R)-3-(4,4-dimethylcycloh...)Show SMILES COc1ccc(-c2ccc(s2)C(=O)N(C)[C@H]2CCN(C2)C(=O)N2CC[C@H](C2)NC2CCC(C)(C)CC2)c(C)c1 Show InChI InChI=1S/C31H44N4O3S/c1-21-18-25(38-5)6-7-26(21)27-8-9-28(39-27)29(36)33(4)24-13-17-35(20-24)30(37)34-16-12-23(19-34)32-22-10-14-31(2,3)15-11-22/h6-9,18,22-24,32H,10-17,19-20H2,1-5H3/t23-,24+/m1/s1 | Reactome pathway
KEGG
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 2.40 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Neurocrine Biosciences Inc.
Curated by ChEMBL
| Assay Description
Binding affinity to MCHR1 by competitive binding assay |
Bioorg Med Chem Lett 16: 4922-30 (2006)
Article DOI: 10.1016/j.bmcl.2006.06.049
BindingDB Entry DOI: 10.7270/Q2TM7BX5 |
More data for this
Ligand-Target Pair | |
Melanin-concentrating hormone receptor 1
(Homo sapiens (Human)) | BDBM50190929
(5-(4-ethylphenyl)-N-methyl-N-((S)-1-((R)-3-(methyl...)Show SMILES CCc1ccc(cc1)-c1ccc(s1)C(=O)N(C)[C@H]1CCN(C1)C(=O)N1CC[C@H](C1)N(C)C1CCOCC1 Show InChI InChI=1S/C29H40N4O3S/c1-4-21-5-7-22(8-6-21)26-9-10-27(37-26)28(34)31(3)25-12-16-33(20-25)29(35)32-15-11-24(19-32)30(2)23-13-17-36-18-14-23/h5-10,23-25H,4,11-20H2,1-3H3/t24-,25+/m1/s1 | Reactome pathway
KEGG
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Neurocrine Biosciences Inc.
Curated by ChEMBL
| Assay Description
Binding affinity to MCHR1 by competitive binding assay |
Bioorg Med Chem Lett 16: 4922-30 (2006)
Article DOI: 10.1016/j.bmcl.2006.06.049
BindingDB Entry DOI: 10.7270/Q2TM7BX5 |
More data for this
Ligand-Target Pair | |
Corticotropin-releasing factor receptor 1
(Homo sapiens (Human)) | BDBM50074501
(Butyl-ethyl-[2,5,6-trimethyl-7-(2,4,6-trimethyl-ph...)Show SMILES CCCCN(CC)c1nc(C)nc2n(c(C)c(C)c12)-c1c(C)cc(C)cc1C |(4.9,1.82,;3.57,2.56,;2.24,1.79,;.91,2.55,;-.44,1.78,;-1.76,2.55,;-3.1,1.78,;-.42,.25,;-1.75,-.52,;-1.75,-2.06,;-3.08,-2.83,;-.42,-2.83,;.91,-2.06,;2.38,-2.54,;3.31,-1.29,;4.85,-1.29,;2.38,-.03,;2.86,1.43,;.91,-.52,;2.86,-4.02,;4.37,-4.33,;5.39,-3.17,;4.85,-5.78,;3.82,-6.93,;4.31,-8.4,;2.32,-6.61,;1.84,-5.14,;.33,-4.82,)| Show InChI InChI=1S/C24H34N4/c1-9-11-12-27(10-2)23-21-18(6)19(7)28(24(21)26-20(8)25-23)22-16(4)13-15(3)14-17(22)5/h13-14H,9-12H2,1-8H3 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| Purchase
CHEMBL
MCE
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| 3.10 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Neurocrine Biosciences Inc.
Curated by ChEMBL
| Assay Description
Binding affinity for corticotropin-releasing factor-1 expressed in leukocyte tyrosine kinase cells |
J Med Chem 48: 5104-7 (2005)
Article DOI: 10.1021/jm050384+
BindingDB Entry DOI: 10.7270/Q2610ZVM |
More data for this
Ligand-Target Pair | |
Melanin-concentrating hormone receptor 1
(Homo sapiens (Human)) | BDBM50190918
(CHEMBL215067 | N-((S)-1-((R)-3-(4,4-dimethylcycloh...)Show SMILES CN([C@H]1CCN(C1)C(=O)N1CC[C@H](C1)NC1CCC(C)(C)CC1)C(=O)c1ccc(s1)-c1ccc(cc1)C(F)(F)F Show InChI InChI=1S/C30H39F3N4O2S/c1-29(2)14-10-22(11-15-29)34-23-12-16-36(18-23)28(39)37-17-13-24(19-37)35(3)27(38)26-9-8-25(40-26)20-4-6-21(7-5-20)30(31,32)33/h4-9,22-24,34H,10-19H2,1-3H3/t23-,24+/m1/s1 | Reactome pathway
KEGG
UniProtKB/SwissProt
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GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 3.70 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Neurocrine Biosciences Inc.
Curated by ChEMBL
| Assay Description
Binding affinity to MCHR1 by competitive binding assay |
Bioorg Med Chem Lett 16: 4922-30 (2006)
Article DOI: 10.1016/j.bmcl.2006.06.049
BindingDB Entry DOI: 10.7270/Q2TM7BX5 |
More data for this
Ligand-Target Pair | |
Melanin-concentrating hormone receptor 1
(Homo sapiens (Human)) | BDBM50190925
(4'-Ethyl-biphenyl-4-carboxylic acid methyl-[(S)-1-...)Show SMILES CCc1ccc(cc1)-c1ccc(cc1)C(=O)N(C)[C@H]1CCN(C1)C(=O)N1CC[C@H](C1)N1CCCCC1 Show InChI InChI=1S/C30H40N4O2/c1-3-23-7-9-24(10-8-23)25-11-13-26(14-12-25)29(35)31(2)27-15-19-33(21-27)30(36)34-20-16-28(22-34)32-17-5-4-6-18-32/h7-14,27-28H,3-6,15-22H2,1-2H3/t27-,28+/m0/s1 | Reactome pathway
KEGG
UniProtKB/SwissProt
antibodypedia
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 |
Neurocrine Biosciences Inc.
Curated by ChEMBL
| Assay Description
Binding affinity to MCHR1 by competitive binding assay |
Bioorg Med Chem Lett 16: 4922-30 (2006)
Article DOI: 10.1016/j.bmcl.2006.06.049
BindingDB Entry DOI: 10.7270/Q2TM7BX5 |
More data for this
Ligand-Target Pair | |
Melanin-concentrating hormone receptor 1
(Homo sapiens (Human)) | BDBM50190920
(4'-ethyl-biphenyl-4-carboxylic acid {(S)-1-[(R)-3-...)Show SMILES CCc1ccc(cc1)-c1ccc(cc1)C(=O)N(C)[C@H]1CCN(C1)C(=O)N1CC[C@H](C1)N[C@@H](C)C(C)C Show InChI InChI=1S/C30H42N4O2/c1-6-23-7-9-24(10-8-23)25-11-13-26(14-12-25)29(35)32(5)28-16-18-34(20-28)30(36)33-17-15-27(19-33)31-22(4)21(2)3/h7-14,21-22,27-28,31H,6,15-20H2,1-5H3/t22-,27+,28-/m0/s1 | Reactome pathway
KEGG
UniProtKB/SwissProt
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 |
Neurocrine Biosciences Inc.
Curated by ChEMBL
| Assay Description
Binding affinity to MCHR1 by competitive binding assay |
Bioorg Med Chem Lett 16: 4922-30 (2006)
Article DOI: 10.1016/j.bmcl.2006.06.049
BindingDB Entry DOI: 10.7270/Q2TM7BX5 |
More data for this
Ligand-Target Pair | |
Melanin-concentrating hormone receptor 1
(Homo sapiens (Human)) | BDBM50190268
(4'-methylsulfanyl-biphenyl-4-carboxylic acid methy...)Show SMILES CSc1ccc(cc1)-c1ccc(cc1)C(=O)N(C)[C@H]1CCN(C1)C(=O)N1CC[C@@H](C1)NCCCc1ccccc1 Show InChI InChI=1S/C33H40N4O2S/c1-35(32(38)28-12-10-26(11-13-28)27-14-16-31(40-2)17-15-27)30-19-22-37(24-30)33(39)36-21-18-29(23-36)34-20-6-9-25-7-4-3-5-8-25/h3-5,7-8,10-17,29-30,34H,6,9,18-24H2,1-2H3/t29-,30-/m0/s1 | Reactome pathway
KEGG
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| 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 |
Neurocrine Biosciences Inc.
Curated by ChEMBL
| Assay Description
Displacement of [125I-Tyr13]MCH from human MCHR1 expressed in HEK293 cells |
Bioorg Med Chem Lett 16: 4450-7 (2006)
Article DOI: 10.1016/j.bmcl.2006.06.045
BindingDB Entry DOI: 10.7270/Q23J3CKC |
More data for this
Ligand-Target Pair | |
Corticotropin-releasing factor receptor 1
(Homo sapiens (Human)) | BDBM50171325
(2-(2,4-Dichloro-phenyl)-4-methyl-6-(1-propyl-butyl...)Show SMILES CCCC(CCC)N1CCn2nc(-c3ccc(Cl)cc3Cl)c3nc(C)cc1c23 Show InChI InChI=1S/C22H26Cl2N4/c1-4-6-16(7-5-2)27-10-11-28-22-19(27)12-14(3)25-21(22)20(26-28)17-9-8-15(23)13-18(17)24/h8-9,12-13,16H,4-7,10-11H2,1-3H3 | PDB
MMDB
Reactome pathway
KEGG
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| Article
PubMed
| 4.5 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Neurocrine Biosciences Inc.
Curated by ChEMBL
| Assay Description
Binding affinity for corticotropin-releasing factor-1 expressed in leukocyte tyrosine kinase cells |
J Med Chem 48: 5104-7 (2005)
Article DOI: 10.1021/jm050384+
BindingDB Entry DOI: 10.7270/Q2610ZVM |
More data for this
Ligand-Target Pair | |
Melanin-concentrating hormone receptor 1
(Homo sapiens (Human)) | BDBM50190947
(4'-ethyl-biphenyl-4-carboxylic acid {(S)-1-[(R)-3-...)Show SMILES CCc1ccc(cc1)-c1ccc(cc1)C(=O)N(C)[C@H]1CCN(C1)C(=O)N1CC[C@H](C1)NCCCC1CCCCC1 Show InChI InChI=1S/C34H48N4O2/c1-3-26-11-13-28(14-12-26)29-15-17-30(18-16-29)33(39)36(2)32-20-23-38(25-32)34(40)37-22-19-31(24-37)35-21-7-10-27-8-5-4-6-9-27/h11-18,27,31-32,35H,3-10,19-25H2,1-2H3/t31-,32+/m1/s1 | Reactome pathway
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PubMed
| 4.90 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Neurocrine Biosciences Inc.
Curated by ChEMBL
| Assay Description
Binding affinity to MCHR1 by competitive binding assay |
Bioorg Med Chem Lett 16: 4922-30 (2006)
Article DOI: 10.1016/j.bmcl.2006.06.049
BindingDB Entry DOI: 10.7270/Q2TM7BX5 |
More data for this
Ligand-Target Pair | |
Melanin-concentrating hormone receptor 1
(Homo sapiens (Human)) | BDBM50190934
(4'-ethyl-biphenyl-4-carboxylic acid methyl-{(S)-1-...)Show SMILES CCc1ccc(cc1)-c1ccc(cc1)C(=O)N(C)[C@H]1CCN(C1)C(=O)N1CC[C@H](C1)NC1CCOCC1 Show InChI InChI=1S/C30H40N4O3/c1-3-22-4-6-23(7-5-22)24-8-10-25(11-9-24)29(35)32(2)28-13-17-34(21-28)30(36)33-16-12-27(20-33)31-26-14-18-37-19-15-26/h4-11,26-28,31H,3,12-21H2,1-2H3/t27-,28+/m1/s1 | Reactome pathway
KEGG
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PubMed
| 5 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Neurocrine Biosciences Inc.
Curated by ChEMBL
| Assay Description
Binding affinity to MCHR1 by competitive binding assay |
Bioorg Med Chem Lett 16: 4922-30 (2006)
Article DOI: 10.1016/j.bmcl.2006.06.049
BindingDB Entry DOI: 10.7270/Q2TM7BX5 |
More data for this
Ligand-Target Pair | |
Melanin-concentrating hormone receptor 1
(Homo sapiens (Human)) | BDBM50190921
(CHEMBL267797 | N-((S)-1-((R)-3-(dimethylamino)pyrr...)Show SMILES CCc1ccc(cc1)-c1ccc(s1)C(=O)N(C)[C@H]1CCN(C1)C(=O)N1CC[C@H](C1)N(C)C Show InChI InChI=1S/C25H34N4O2S/c1-5-18-6-8-19(9-7-18)22-10-11-23(32-22)24(30)27(4)21-13-15-29(17-21)25(31)28-14-12-20(16-28)26(2)3/h6-11,20-21H,5,12-17H2,1-4H3/t20-,21+/m1/s1 | Reactome pathway
KEGG
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PubMed
| 5 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Neurocrine Biosciences Inc.
Curated by ChEMBL
| Assay Description
Binding affinity to MCHR1 by competitive binding assay |
Bioorg Med Chem Lett 16: 4922-30 (2006)
Article DOI: 10.1016/j.bmcl.2006.06.049
BindingDB Entry DOI: 10.7270/Q2TM7BX5 |
More data for this
Ligand-Target Pair | |
Corticotropin-releasing factor receptor 1
(Homo sapiens (Human)) | BDBM50171322
(1-(2,4-Dichloro-phenyl)-7-methyl-5-(1-propyl-butyl...)Show SMILES CCCC(CCC)N1CCn2c3c1cc(C)nc3n(-c1ccc(Cl)cc1Cl)c2=O |(2.62,5.41,;2.62,3.85,;1.29,3.08,;1.27,1.53,;-.06,.76,;-1.39,1.53,;-2.73,.76,;2.62,.75,;3.96,1.52,;5.29,.75,;5.28,-.79,;3.95,-1.57,;2.62,-.8,;1.29,-1.57,;1.29,-3.12,;-.2,-3.56,;3.14,-4.12,;4.28,-3.08,;5.82,-3.23,;6.78,-4.44,;6.22,-5.86,;7.2,-7.06,;8.71,-6.83,;9.68,-8.02,;9.26,-5.4,;8.3,-4.21,;8.86,-2.76,;6.43,-1.82,;7.94,-1.5,)| Show InChI InChI=1S/C22H26Cl2N4O/c1-4-6-16(7-5-2)26-10-11-27-20-19(26)12-14(3)25-21(20)28(22(27)29)18-9-8-15(23)13-17(18)24/h8-9,12-13,16H,4-7,10-11H2,1-3H3 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
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UniChem
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PubMed
| 5.10 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Neurocrine Biosciences Inc.
Curated by ChEMBL
| Assay Description
Binding affinity for corticotropin-releasing factor-1 expressed in leukocyte tyrosine kinase cells |
J Med Chem 48: 5104-7 (2005)
Article DOI: 10.1021/jm050384+
BindingDB Entry DOI: 10.7270/Q2610ZVM |
More data for this
Ligand-Target Pair | |
Melanin-concentrating hormone receptor 1
(Homo sapiens (Human)) | BDBM50190932
(4'-methoxy-2'-methyl-biphenyl-4-carboxylic acid {(...)Show SMILES COc1ccc(c(C)c1)-c1ccc(cc1)C(=O)N(C)[C@H]1CCN(C1)C(=O)N1CC[C@H](C1)NCCCC1CCCCC1 Show InChI InChI=1S/C34H48N4O3/c1-25-22-31(41-3)15-16-32(25)27-11-13-28(14-12-27)33(39)36(2)30-18-21-38(24-30)34(40)37-20-17-29(23-37)35-19-7-10-26-8-5-4-6-9-26/h11-16,22,26,29-30,35H,4-10,17-21,23-24H2,1-3H3/t29-,30+/m1/s1 | Reactome pathway
KEGG
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PubMed
| 5.70 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Neurocrine Biosciences Inc.
Curated by ChEMBL
| Assay Description
Binding affinity to MCHR1 by competitive binding assay |
Bioorg Med Chem Lett 16: 4922-30 (2006)
Article DOI: 10.1016/j.bmcl.2006.06.049
BindingDB Entry DOI: 10.7270/Q2TM7BX5 |
More data for this
Ligand-Target Pair | |
Melanin-concentrating hormone receptor 1
(Homo sapiens (Human)) | BDBM50190279
(4'-chloro-biphenyl-4-carboxylic acid methyl-{(S)-1...)Show SMILES CN([C@H]1CCN(C1)C(=O)N1CC[C@@H](C1)NCCCc1ccccc1)C(=O)c1ccc(cc1)-c1ccc(Cl)cc1 Show InChI InChI=1S/C32H37ClN4O2/c1-35(31(38)27-11-9-25(10-12-27)26-13-15-28(33)16-14-26)30-18-21-37(23-30)32(39)36-20-17-29(22-36)34-19-5-8-24-6-3-2-4-7-24/h2-4,6-7,9-16,29-30,34H,5,8,17-23H2,1H3/t29-,30-/m0/s1 | Reactome pathway
KEGG
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PubMed
| 6 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Neurocrine Biosciences Inc.
Curated by ChEMBL
| Assay Description
Displacement of [125I-Tyr13]MCH from human MCHR1 expressed in HEK293 cells |
Bioorg Med Chem Lett 16: 4450-7 (2006)
Article DOI: 10.1016/j.bmcl.2006.06.045
BindingDB Entry DOI: 10.7270/Q23J3CKC |
More data for this
Ligand-Target Pair | |
Melanin-concentrating hormone receptor 1
(Homo sapiens (Human)) | BDBM50190944
(5-(4-ethylphenyl)-N-methyl-N-((S)-1-((R)-3-(methyl...)Show SMILES CCc1ccc(cc1)-c1ccc(s1)C(=O)N(C)[C@H]1CCN(C1)C(=O)N1CC[C@H](C1)NC Show InChI InChI=1S/C24H32N4O2S/c1-4-17-5-7-18(8-6-17)21-9-10-22(31-21)23(29)26(3)20-12-14-28(16-20)24(30)27-13-11-19(15-27)25-2/h5-10,19-20,25H,4,11-16H2,1-3H3/t19-,20+/m1/s1 | Reactome pathway
KEGG
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PubMed
| 6 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Neurocrine Biosciences Inc.
Curated by ChEMBL
| Assay Description
Binding affinity to MCHR1 by competitive binding assay |
Bioorg Med Chem Lett 16: 4922-30 (2006)
Article DOI: 10.1016/j.bmcl.2006.06.049
BindingDB Entry DOI: 10.7270/Q2TM7BX5 |
More data for this
Ligand-Target Pair | |
Melanin-concentrating hormone receptor 1
(Homo sapiens (Human)) | BDBM50190280
(4'-trifluoromethoxy-biphenyl-4-carboxylic acid met...)Show SMILES CN([C@H]1CCN(C1)C(=O)N1CC[C@@H](C1)NCCCc1ccccc1)C(=O)c1ccc(cc1)-c1ccc(OC(F)(F)F)cc1 Show InChI InChI=1S/C33H37F3N4O3/c1-38(31(41)27-11-9-25(10-12-27)26-13-15-30(16-14-26)43-33(34,35)36)29-18-21-40(23-29)32(42)39-20-17-28(22-39)37-19-5-8-24-6-3-2-4-7-24/h2-4,6-7,9-16,28-29,37H,5,8,17-23H2,1H3/t28-,29-/m0/s1 | Reactome pathway
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PubMed
| 7 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Neurocrine Biosciences Inc.
Curated by ChEMBL
| Assay Description
Displacement of [125I-Tyr13]MCH from human MCHR1 expressed in HEK293 cells |
Bioorg Med Chem Lett 16: 4450-7 (2006)
Article DOI: 10.1016/j.bmcl.2006.06.045
BindingDB Entry DOI: 10.7270/Q23J3CKC |
More data for this
Ligand-Target Pair | |
Melanin-concentrating hormone receptor 1
(Homo sapiens (Human)) | BDBM50190933
(5-(4-ethylphenyl)-N-methyl-N-((S)-1-((R)-3-((tetra...)Show SMILES CCc1ccc(cc1)-c1ccc(s1)C(=O)N(C)[C@H]1CCN(C1)C(=O)N1CC[C@H](C1)NCC1CCOCC1 Show InChI InChI=1S/C29H40N4O3S/c1-3-21-4-6-23(7-5-21)26-8-9-27(37-26)28(34)31(2)25-11-15-33(20-25)29(35)32-14-10-24(19-32)30-18-22-12-16-36-17-13-22/h4-9,22,24-25,30H,3,10-20H2,1-2H3/t24-,25+/m1/s1 | Reactome pathway
KEGG
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PubMed
| 8 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Neurocrine Biosciences Inc.
Curated by ChEMBL
| Assay Description
Binding affinity to MCHR1 by competitive binding assay |
Bioorg Med Chem Lett 16: 4922-30 (2006)
Article DOI: 10.1016/j.bmcl.2006.06.049
BindingDB Entry DOI: 10.7270/Q2TM7BX5 |
More data for this
Ligand-Target Pair | |
Corticotropin-releasing factor receptor 1
(Homo sapiens (Human)) | BDBM50171316
(5-(1-Ethyl-propyl)-1-(4-methoxy-phenyl)-7-methyl-4...)Show SMILES CCC(CC)N1CCn2c3c1cc(C)nc3n(-c1ccc(OC)cc1)c2=O Show InChI InChI=1S/C21H26N4O2/c1-5-15(6-2)23-11-12-24-19-18(23)13-14(3)22-20(19)25(21(24)26)16-7-9-17(27-4)10-8-16/h7-10,13,15H,5-6,11-12H2,1-4H3 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
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PubMed
| 8 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Neurocrine Biosciences Inc.
Curated by ChEMBL
| Assay Description
Binding affinity for corticotropin-releasing factor-1 expressed in leukocyte tyrosine kinase cells |
J Med Chem 48: 5104-7 (2005)
Article DOI: 10.1021/jm050384+
BindingDB Entry DOI: 10.7270/Q2610ZVM |
More data for this
Ligand-Target Pair | |
Melanin-concentrating hormone receptor 1
(Homo sapiens (Human)) | BDBM50190267
(4'-methoxy-biphenyl-4-carboxylic acid methyl-{(S)-...)Show SMILES COc1ccc(cc1)-c1ccc(cc1)C(=O)N(C)[C@H]1CCN(C1)C(=O)N1CC[C@@H](C1)NCCCc1ccccc1 Show InChI InChI=1S/C33H40N4O3/c1-35(32(38)28-12-10-26(11-13-28)27-14-16-31(40-2)17-15-27)30-19-22-37(24-30)33(39)36-21-18-29(23-36)34-20-6-9-25-7-4-3-5-8-25/h3-5,7-8,10-17,29-30,34H,6,9,18-24H2,1-2H3/t29-,30-/m0/s1 | Reactome pathway
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| 8 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Neurocrine Biosciences Inc.
Curated by ChEMBL
| Assay Description
Displacement of [125I-Tyr13]MCH from human MCHR1 expressed in HEK293 cells |
Bioorg Med Chem Lett 16: 4450-7 (2006)
Article DOI: 10.1016/j.bmcl.2006.06.045
BindingDB Entry DOI: 10.7270/Q23J3CKC |
More data for this
Ligand-Target Pair | |
Melanin-concentrating hormone receptor 1
(Homo sapiens (Human)) | BDBM50190296
(4'-trifluoromethyl-biphenyl-4-carboxylic acid meth...)Show SMILES CN([C@H]1CCN(C1)C(=O)N1CC[C@H](C1)NCCCc1ccccc1)C(=O)c1ccc(cc1)-c1ccc(cc1)C(F)(F)F Show InChI InChI=1S/C33H37F3N4O2/c1-38(31(41)27-11-9-25(10-12-27)26-13-15-28(16-14-26)33(34,35)36)30-18-21-40(23-30)32(42)39-20-17-29(22-39)37-19-5-8-24-6-3-2-4-7-24/h2-4,6-7,9-16,29-30,37H,5,8,17-23H2,1H3/t29-,30+/m1/s1 | Reactome pathway
KEGG
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| Article
PubMed
| 10 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Neurocrine Biosciences Inc.
Curated by ChEMBL
| Assay Description
Displacement of [125I-Tyr13]MCH from human MCHR1 expressed in HEK293 cells |
Bioorg Med Chem Lett 16: 4450-7 (2006)
Article DOI: 10.1016/j.bmcl.2006.06.045
BindingDB Entry DOI: 10.7270/Q23J3CKC |
More data for this
Ligand-Target Pair | |
Melanin-concentrating hormone receptor 1
(Homo sapiens (Human)) | BDBM50190936
(5-(4-methoxyphenyl)-N-methyl-N-((S)-1-((R)-3-(tetr...)Show SMILES COc1ccc(cc1)-c1ccc(s1)C(=O)N(C)[C@H]1CCN(C1)C(=O)N1CC[C@H](C1)NC1CCOCC1 Show InChI InChI=1S/C27H36N4O4S/c1-29(26(32)25-8-7-24(36-25)19-3-5-23(34-2)6-4-19)22-10-14-31(18-22)27(33)30-13-9-21(17-30)28-20-11-15-35-16-12-20/h3-8,20-22,28H,9-18H2,1-2H3/t21-,22+/m1/s1 | Reactome pathway
KEGG
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PubMed
| 10 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Neurocrine Biosciences Inc.
Curated by ChEMBL
| Assay Description
Binding affinity to MCHR1 by competitive binding assay |
Bioorg Med Chem Lett 16: 4922-30 (2006)
Article DOI: 10.1016/j.bmcl.2006.06.049
BindingDB Entry DOI: 10.7270/Q2TM7BX5 |
More data for this
Ligand-Target Pair | |
Melanin-concentrating hormone receptor 1
(Homo sapiens (Human)) | BDBM50190939
(4'-ethyl-biphenyl-4-carboxylic acid [(S)-1-((R)-3-...)Show SMILES CCc1ccc(cc1)-c1ccc(cc1)C(=O)N(C)[C@H]1CCN(C1)C(=O)N1CC[C@H](C1)NC(C)C Show InChI InChI=1S/C28H38N4O2/c1-5-21-6-8-22(9-7-21)23-10-12-24(13-11-23)27(33)30(4)26-15-17-32(19-26)28(34)31-16-14-25(18-31)29-20(2)3/h6-13,20,25-26,29H,5,14-19H2,1-4H3/t25-,26+/m1/s1 | Reactome pathway
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| 11 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Neurocrine Biosciences Inc.
Curated by ChEMBL
| Assay Description
Binding affinity to MCHR1 by competitive binding assay |
Bioorg Med Chem Lett 16: 4922-30 (2006)
Article DOI: 10.1016/j.bmcl.2006.06.049
BindingDB Entry DOI: 10.7270/Q2TM7BX5 |
More data for this
Ligand-Target Pair | |
Melanin-concentrating hormone receptor 1
(Homo sapiens (Human)) | BDBM50190938
(5-(4-ethylphenyl)-N-((S)-1-((R)-3-(isopropylamino)...)Show SMILES CCc1ccc(cc1)-c1ccc(s1)C(=O)N(C)[C@H]1CCN(C1)C(=O)N1CC[C@H](C1)NC(C)C Show InChI InChI=1S/C26H36N4O2S/c1-5-19-6-8-20(9-7-19)23-10-11-24(33-23)25(31)28(4)22-13-15-30(17-22)26(32)29-14-12-21(16-29)27-18(2)3/h6-11,18,21-22,27H,5,12-17H2,1-4H3/t21-,22+/m1/s1 | Reactome pathway
KEGG
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PubMed
| 11 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Neurocrine Biosciences Inc.
Curated by ChEMBL
| Assay Description
Binding affinity to MCHR1 by competitive binding assay |
Bioorg Med Chem Lett 16: 4922-30 (2006)
Article DOI: 10.1016/j.bmcl.2006.06.049
BindingDB Entry DOI: 10.7270/Q2TM7BX5 |
More data for this
Ligand-Target Pair | |
Melanin-concentrating hormone receptor 1
(Homo sapiens (Human)) | BDBM50190293
(4'-trifluoromethyl-biphenyl-4-carboxylic acid {(S)...)Show SMILES CN([C@H]1CCN(C1)C(=O)N1CC[C@H](C1)NCC1CCC1)C(=O)c1ccc(cc1)-c1ccc(cc1)C(F)(F)F Show InChI InChI=1S/C29H35F3N4O2/c1-34(27(37)23-7-5-21(6-8-23)22-9-11-24(12-10-22)29(30,31)32)26-14-16-36(19-26)28(38)35-15-13-25(18-35)33-17-20-3-2-4-20/h5-12,20,25-26,33H,2-4,13-19H2,1H3/t25-,26+/m1/s1 | Reactome pathway
KEGG
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| 11 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Neurocrine Biosciences Inc.
Curated by ChEMBL
| Assay Description
Displacement of [125I-Tyr13]MCH from human MCHR1 expressed in HEK293 cells |
Bioorg Med Chem Lett 16: 4450-7 (2006)
Article DOI: 10.1016/j.bmcl.2006.06.045
BindingDB Entry DOI: 10.7270/Q23J3CKC |
More data for this
Ligand-Target Pair | |
Melanin-concentrating hormone receptor 1
(Homo sapiens (Human)) | BDBM50190263
(4'-trifluoromethyl-biphenyl-4-carboxylic acid meth...)Show SMILES CN([C@H]1CCN(C1)C(=O)N1CC[C@@H](C1)NCCCc1ccccc1)C(=O)c1ccc(cc1)-c1ccc(cc1)C(F)(F)F Show InChI InChI=1S/C33H37F3N4O2/c1-38(31(41)27-11-9-25(10-12-27)26-13-15-28(16-14-26)33(34,35)36)30-18-21-40(23-30)32(42)39-20-17-29(22-39)37-19-5-8-24-6-3-2-4-7-24/h2-4,6-7,9-16,29-30,37H,5,8,17-23H2,1H3/t29-,30-/m0/s1 | Reactome pathway
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| 11 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Neurocrine Biosciences Inc.
Curated by ChEMBL
| Assay Description
Displacement of [125I-Tyr13]MCH from human MCHR1 expressed in HEK293 cells |
Bioorg Med Chem Lett 16: 4450-7 (2006)
Article DOI: 10.1016/j.bmcl.2006.06.045
BindingDB Entry DOI: 10.7270/Q23J3CKC |
More data for this
Ligand-Target Pair | |
Melanin-concentrating hormone receptor 1
(Homo sapiens (Human)) | BDBM50190281
(4'-trifluoromethyl-biphenyl-4-carboxylic acid {(S)...)Show SMILES CN([C@H]1CCN(C1)C(=O)N1CC[C@H](C1)NCC1CCCCC1)C(=O)c1ccc(cc1)-c1ccc(cc1)C(F)(F)F Show InChI InChI=1S/C31H39F3N4O2/c1-36(29(39)25-9-7-23(8-10-25)24-11-13-26(14-12-24)31(32,33)34)28-16-18-38(21-28)30(40)37-17-15-27(20-37)35-19-22-5-3-2-4-6-22/h7-14,22,27-28,35H,2-6,15-21H2,1H3/t27-,28+/m1/s1 | Reactome pathway
KEGG
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| 12 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Neurocrine Biosciences Inc.
Curated by ChEMBL
| Assay Description
Displacement of [125I-Tyr13]MCH from human MCHR1 expressed in HEK293 cells |
Bioorg Med Chem Lett 16: 4450-7 (2006)
Article DOI: 10.1016/j.bmcl.2006.06.045
BindingDB Entry DOI: 10.7270/Q23J3CKC |
More data for this
Ligand-Target Pair | |
Corticotropin-releasing factor receptor 1
(Homo sapiens (Human)) | BDBM50171328
(1-(4-Chloro-phenyl)-7-methyl-5-(1-propyl-butyl)-4,...)Show SMILES CCCC(CCC)N1CCn2c3c1cc(C)nc3n(-c1ccc(Cl)cc1)c2=O Show InChI InChI=1S/C22H27ClN4O/c1-4-6-17(7-5-2)25-12-13-26-20-19(25)14-15(3)24-21(20)27(22(26)28)18-10-8-16(23)9-11-18/h8-11,14,17H,4-7,12-13H2,1-3H3 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
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PubMed
| 12 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Neurocrine Biosciences Inc.
Curated by ChEMBL
| Assay Description
Binding affinity for corticotropin-releasing factor-1 expressed in leukocyte tyrosine kinase cells |
J Med Chem 48: 5104-7 (2005)
Article DOI: 10.1021/jm050384+
BindingDB Entry DOI: 10.7270/Q2610ZVM |
More data for this
Ligand-Target Pair | |
Melanin-concentrating hormone receptor 1
(Homo sapiens (Human)) | BDBM50190261
(4'-trifluoromethyl-biphenyl-4-carboxylic acid meth...)Show SMILES CC1CCC(CC1)N[C@@H]1CCN(C1)C(=O)N1CC[C@@H](C1)N(C)C(=O)c1ccc(cc1)-c1ccc(cc1)C(F)(F)F |wU:18.22,wD:8.8,(35.05,-22.48,;35.8,-21.14,;35.02,-19.81,;35.76,-18.47,;37.3,-18.45,;38.1,-19.76,;37.34,-21.11,;38.04,-17.1,;36.94,-16.03,;35.69,-16.92,;34.45,-16,;34.95,-14.55,;36.49,-14.56,;34.14,-13.24,;34.87,-11.88,;32.6,-13.29,;31.65,-12.07,;30.21,-12.59,;30.26,-14.13,;31.73,-14.56,;28.93,-14.91,;28.94,-16.45,;27.59,-14.15,;27.58,-12.61,;26.26,-14.93,;26.27,-16.47,;24.94,-17.24,;23.61,-16.47,;23.59,-14.94,;24.92,-14.16,;22.28,-17.25,;22.29,-18.8,;20.94,-19.57,;19.61,-18.8,;19.62,-17.26,;20.94,-16.49,;18.28,-19.57,;16.94,-20.33,;19.04,-20.91,;17.51,-18.23,)| Show InChI InChI=1S/C31H39F3N4O2/c1-21-3-13-26(14-4-21)35-27-15-17-37(19-27)30(40)38-18-16-28(20-38)36(2)29(39)24-7-5-22(6-8-24)23-9-11-25(12-10-23)31(32,33)34/h5-12,21,26-28,35H,3-4,13-20H2,1-2H3/t21?,26?,27-,28+/m1/s1 | Reactome pathway
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| 13 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Neurocrine Biosciences Inc.
Curated by ChEMBL
| Assay Description
Displacement of [125I-Tyr13]MCH from human MCHR1 expressed in HEK293 cells |
Bioorg Med Chem Lett 16: 4450-7 (2006)
Article DOI: 10.1016/j.bmcl.2006.06.045
BindingDB Entry DOI: 10.7270/Q23J3CKC |
More data for this
Ligand-Target Pair | |
Melanin-concentrating hormone receptor 1
(Homo sapiens (Human)) | BDBM50190290
(4'-trifluoromethyl-biphenyl-4-carboxylic acid ((S)...)Show SMILES CN([C@H]1CCN(C1)C(=O)N1CC[C@H](C1)NCCC(C)(C)c1ccc(Cl)cc1)C(=O)c1ccc(cc1)-c1ccc(cc1)C(F)(F)F Show InChI InChI=1S/C35H40ClF3N4O2/c1-34(2,27-12-14-29(36)15-13-27)18-19-40-30-16-20-42(22-30)33(45)43-21-17-31(23-43)41(3)32(44)26-6-4-24(5-7-26)25-8-10-28(11-9-25)35(37,38)39/h4-15,30-31,40H,16-23H2,1-3H3/t30-,31+/m1/s1 | Reactome pathway
KEGG
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PubMed
| 14 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Neurocrine Biosciences Inc.
Curated by ChEMBL
| Assay Description
Displacement of [125I-Tyr13]MCH from human MCHR1 expressed in HEK293 cells |
Bioorg Med Chem Lett 16: 4450-7 (2006)
Article DOI: 10.1016/j.bmcl.2006.06.045
BindingDB Entry DOI: 10.7270/Q23J3CKC |
More data for this
Ligand-Target Pair | |
Melanin-concentrating hormone receptor 1
(Homo sapiens (Human)) | BDBM50190935
(4'-ethyl-biphenyl-4-carboxylic acid {(S)-1-[(R)-3-...)Show SMILES CCc1ccc(cc1)-c1ccc(cc1)C(=O)N(C)[C@H]1CCN(C1)C(=O)N1CC[C@H](C1)N[C@@H](C)COC Show InChI InChI=1S/C29H40N4O3/c1-5-22-6-8-23(9-7-22)24-10-12-25(13-11-24)28(34)31(3)27-15-17-33(19-27)29(35)32-16-14-26(18-32)30-21(2)20-36-4/h6-13,21,26-27,30H,5,14-20H2,1-4H3/t21-,26+,27-/m0/s1 | Reactome pathway
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| 14 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Neurocrine Biosciences Inc.
Curated by ChEMBL
| Assay Description
Binding affinity to MCHR1 by competitive binding assay |
Bioorg Med Chem Lett 16: 4922-30 (2006)
Article DOI: 10.1016/j.bmcl.2006.06.049
BindingDB Entry DOI: 10.7270/Q2TM7BX5 |
More data for this
Ligand-Target Pair | |
Melanin-concentrating hormone receptor 1
(Homo sapiens (Human)) | BDBM50190303
(4'-trifluoromethyl-biphenyl-4-carboxylic acid [(S)...)Show SMILES CN(CCC(C)(C)c1ccc(Cl)cc1)[C@@H]1CCN(C1)C(=O)N1CC[C@@H](C1)N(C)C(=O)c1ccc(cc1)-c1ccc(cc1)C(F)(F)F Show InChI InChI=1S/C36H42ClF3N4O2/c1-35(2,28-13-15-30(37)16-14-28)19-22-41(3)31-17-20-43(23-31)34(46)44-21-18-32(24-44)42(4)33(45)27-7-5-25(6-8-27)26-9-11-29(12-10-26)36(38,39)40/h5-16,31-32H,17-24H2,1-4H3/t31-,32+/m1/s1 | Reactome pathway
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| 14 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Neurocrine Biosciences Inc.
Curated by ChEMBL
| Assay Description
Displacement of [125I-Tyr13]MCH from human MCHR1 expressed in HEK293 cells |
Bioorg Med Chem Lett 16: 4450-7 (2006)
Article DOI: 10.1016/j.bmcl.2006.06.045
BindingDB Entry DOI: 10.7270/Q23J3CKC |
More data for this
Ligand-Target Pair | |
Melanin-concentrating hormone receptor 1
(Homo sapiens (Human)) | BDBM50190274
(4'-trifluoromethyl-biphenyl-4-carboxylic acid meth...)Show SMILES CN([C@H]1CCN(C1)C(=O)N1CC[C@H](C1)NCCCC(F)(F)F)C(=O)c1ccc(cc1)-c1ccc(cc1)C(F)(F)F Show InChI InChI=1S/C28H32F6N4O2/c1-36(25(39)21-5-3-19(4-6-21)20-7-9-22(10-8-20)28(32,33)34)24-12-16-38(18-24)26(40)37-15-11-23(17-37)35-14-2-13-27(29,30)31/h3-10,23-24,35H,2,11-18H2,1H3/t23-,24+/m1/s1 | Reactome pathway
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PubMed
| 16 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Neurocrine Biosciences Inc.
Curated by ChEMBL
| Assay Description
Displacement of [125I-Tyr13]MCH from human MCHR1 expressed in HEK293 cells |
Bioorg Med Chem Lett 16: 4450-7 (2006)
Article DOI: 10.1016/j.bmcl.2006.06.045
BindingDB Entry DOI: 10.7270/Q23J3CKC |
More data for this
Ligand-Target Pair | |
Melanin-concentrating hormone receptor 1
(Homo sapiens (Human)) | BDBM50190923
(CHEMBL386969 | N-((S)-1-((R)-3-(4,4-dimethylcycloh...)Show SMILES CCOc1ccc(cc1)-c1ccc(s1)C(=O)N(C)[C@H]1CCN(C1)C(=O)N1CC[C@H](C1)NC1CCC(C)(C)CC1 Show InChI InChI=1S/C31H44N4O3S/c1-5-38-26-8-6-22(7-9-26)27-10-11-28(39-27)29(36)33(4)25-15-19-35(21-25)30(37)34-18-14-24(20-34)32-23-12-16-31(2,3)17-13-23/h6-11,23-25,32H,5,12-21H2,1-4H3/t24-,25+/m1/s1 | Reactome pathway
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PubMed
| 16 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Neurocrine Biosciences Inc.
Curated by ChEMBL
| Assay Description
Binding affinity to MCHR1 by competitive binding assay |
Bioorg Med Chem Lett 16: 4922-30 (2006)
Article DOI: 10.1016/j.bmcl.2006.06.049
BindingDB Entry DOI: 10.7270/Q2TM7BX5 |
More data for this
Ligand-Target Pair | |
Melanin-concentrating hormone receptor 1
(Homo sapiens (Human)) | BDBM50190291
(4'-trifluoromethyl-biphenyl-4-carboxylic acid meth...)Show SMILES CN([C@H]1CCN(C1)C(=O)N1CC[C@H](C1)NCCc1ccccc1)C(=O)c1ccc(cc1)-c1ccc(cc1)C(F)(F)F Show InChI InChI=1S/C32H35F3N4O2/c1-37(30(40)26-9-7-24(8-10-26)25-11-13-27(14-12-25)32(33,34)35)29-17-20-39(22-29)31(41)38-19-16-28(21-38)36-18-15-23-5-3-2-4-6-23/h2-14,28-29,36H,15-22H2,1H3/t28-,29+/m1/s1 | Reactome pathway
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| 17 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Neurocrine Biosciences Inc.
Curated by ChEMBL
| Assay Description
Displacement of [125I-Tyr13]MCH from human MCHR1 expressed in HEK293 cells |
Bioorg Med Chem Lett 16: 4450-7 (2006)
Article DOI: 10.1016/j.bmcl.2006.06.045
BindingDB Entry DOI: 10.7270/Q23J3CKC |
More data for this
Ligand-Target Pair | |
Corticotropin-releasing factor receptor 1
(Homo sapiens (Human)) | BDBM50171334
(7-Methyl-5-(1-propyl-butyl)-1-(4-trifluoromethyl-p...)Show SMILES CCCC(CCC)N1CCn2c3c1cc(C)nc3n(-c1ccc(cc1)C(F)(F)F)c2=O Show InChI InChI=1S/C23H27F3N4O/c1-4-6-17(7-5-2)28-12-13-29-20-19(28)14-15(3)27-21(20)30(22(29)31)18-10-8-16(9-11-18)23(24,25)26/h8-11,14,17H,4-7,12-13H2,1-3H3 | PDB
MMDB
Reactome pathway
KEGG
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| 17 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Neurocrine Biosciences Inc.
Curated by ChEMBL
| Assay Description
Binding affinity for corticotropin-releasing factor-1 expressed in leukocyte tyrosine kinase cells |
J Med Chem 48: 5104-7 (2005)
Article DOI: 10.1021/jm050384+
BindingDB Entry DOI: 10.7270/Q2610ZVM |
More data for this
Ligand-Target Pair | |
Melanin-concentrating hormone receptor 1
(Homo sapiens (Human)) | BDBM50190930
(4'-ethyl-biphenyl-4-carboxylic acid [(S)-1-((R)-3-...)Show SMILES CCc1ccc(cc1)-c1ccc(cc1)C(=O)N(C)[C@H]1CCN(C1)C(=O)N1CC[C@@H](N)C1 Show InChI InChI=1S/C25H32N4O2/c1-3-18-4-6-19(7-5-18)20-8-10-21(11-9-20)24(30)27(2)23-13-15-29(17-23)25(31)28-14-12-22(26)16-28/h4-11,22-23H,3,12-17,26H2,1-2H3/t22-,23+/m1/s1 | Reactome pathway
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| 18 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Neurocrine Biosciences Inc.
Curated by ChEMBL
| Assay Description
Binding affinity to MCHR1 by competitive binding assay |
Bioorg Med Chem Lett 16: 4922-30 (2006)
Article DOI: 10.1016/j.bmcl.2006.06.049
BindingDB Entry DOI: 10.7270/Q2TM7BX5 |
More data for this
Ligand-Target Pair | |
Melanin-concentrating hormone receptor 1
(Homo sapiens (Human)) | BDBM50190297
(4'-trifluoromethyl-biphenyl-4-carboxylic acid ((S)...)Show SMILES CN([C@H]1CCN(C1)C(=O)N1CC[C@H](C1)NCCOc1ccc(F)cc1)C(=O)c1ccc(cc1)-c1ccc(cc1)C(F)(F)F Show InChI InChI=1S/C32H34F4N4O3/c1-38(30(41)24-4-2-22(3-5-24)23-6-8-25(9-7-23)32(34,35)36)28-15-18-40(21-28)31(42)39-17-14-27(20-39)37-16-19-43-29-12-10-26(33)11-13-29/h2-13,27-28,37H,14-21H2,1H3/t27-,28+/m1/s1 | Reactome pathway
KEGG
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| 19 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Neurocrine Biosciences Inc.
Curated by ChEMBL
| Assay Description
Displacement of [125I-Tyr13]MCH from human MCHR1 expressed in HEK293 cells |
Bioorg Med Chem Lett 16: 4450-7 (2006)
Article DOI: 10.1016/j.bmcl.2006.06.045
BindingDB Entry DOI: 10.7270/Q23J3CKC |
More data for this
Ligand-Target Pair | |
Melanin-concentrating hormone receptor 1
(Homo sapiens (Human)) | BDBM50190272
(4'-fluoro-biphenyl-4-carboxylic acid methyl-{(S)-1...)Show SMILES CN([C@H]1CCN(C1)C(=O)N1CC[C@@H](C1)NCCCc1ccccc1)C(=O)c1ccc(cc1)-c1ccc(F)cc1 Show InChI InChI=1S/C32H37FN4O2/c1-35(31(38)27-11-9-25(10-12-27)26-13-15-28(33)16-14-26)30-18-21-37(23-30)32(39)36-20-17-29(22-36)34-19-5-8-24-6-3-2-4-7-24/h2-4,6-7,9-16,29-30,34H,5,8,17-23H2,1H3/t29-,30-/m0/s1 | Reactome pathway
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| 19 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Neurocrine Biosciences Inc.
Curated by ChEMBL
| Assay Description
Displacement of [125I-Tyr13]MCH from human MCHR1 expressed in HEK293 cells |
Bioorg Med Chem Lett 16: 4450-7 (2006)
Article DOI: 10.1016/j.bmcl.2006.06.045
BindingDB Entry DOI: 10.7270/Q23J3CKC |
More data for this
Ligand-Target Pair | |
Corticotropin-releasing factor receptor 1
(Homo sapiens (Human)) | BDBM50171321
(5-(1-Ethyl-propyl)-1-(4-methoxy-2-methyl-phenyl)-7...)Show SMILES CCC(CC)N1CCn2c3c1cc(C)nc3n(-c1ccc(OC)cc1C)c2=O |(-2.58,3.06,;-1.25,2.3,;.08,3.06,;.08,4.61,;1.4,5.38,;1.42,2.29,;2.74,3.06,;4.51,1.94,;4.19,.46,;2.74,-.02,;1.42,.74,;.08,-.02,;.08,-1.56,;-1.25,-2.34,;1.42,-2.33,;2.74,-1.56,;4.19,-2.03,;4.81,-3.44,;3.91,-4.67,;4.53,-6.08,;6.07,-6.24,;6.83,-7.55,;8.3,-7.16,;6.97,-5,;6.35,-3.6,;7.24,-2.35,;5.09,-.8,;6.62,-.8,)| Show InChI InChI=1S/C22H28N4O2/c1-6-16(7-2)24-10-11-25-20-19(24)13-15(4)23-21(20)26(22(25)27)18-9-8-17(28-5)12-14(18)3/h8-9,12-13,16H,6-7,10-11H2,1-5H3 | PDB
MMDB
Reactome pathway
KEGG
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| 20 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Neurocrine Biosciences Inc.
Curated by ChEMBL
| Assay Description
Binding affinity for corticotropin-releasing factor-1 expressed in leukocyte tyrosine kinase cells |
J Med Chem 48: 5104-7 (2005)
Article DOI: 10.1021/jm050384+
BindingDB Entry DOI: 10.7270/Q2610ZVM |
More data for this
Ligand-Target Pair | |
Melanin-concentrating hormone receptor 1
(Homo sapiens (Human)) | BDBM50190928
(CHEMBL384234 | N-((S)-1-((R)-3-(3-cyclohexylpropyl...)Show SMILES CCc1ccc(cc1)-c1ccc(s1)C(=O)N(C)[C@H]1CCN(C1)C(=O)N1CC[C@H](C1)NCCCC1CCCCC1 Show InChI InChI=1S/C32H46N4O2S/c1-3-24-11-13-26(14-12-24)29-15-16-30(39-29)31(37)34(2)28-18-21-36(23-28)32(38)35-20-17-27(22-35)33-19-7-10-25-8-5-4-6-9-25/h11-16,25,27-28,33H,3-10,17-23H2,1-2H3/t27-,28+/m1/s1 | Reactome pathway
KEGG
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 21 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Neurocrine Biosciences Inc.
Curated by ChEMBL
| Assay Description
Binding affinity to MCHR1 by competitive binding assay |
Bioorg Med Chem Lett 16: 4922-30 (2006)
Article DOI: 10.1016/j.bmcl.2006.06.049
BindingDB Entry DOI: 10.7270/Q2TM7BX5 |
More data for this
Ligand-Target Pair | |
Melanin-concentrating hormone receptor 1
(Homo sapiens (Human)) | BDBM50190302
(4'-trifluoromethyl-biphenyl-4-carboxylic acid {(S)...)Show SMILES CN([C@H]1CCN(C1)C(=O)N1CC[C@H](C1)NC1CCN(CC1)C(C)=O)C(=O)c1ccc(cc1)-c1ccc(cc1)C(F)(F)F Show InChI InChI=1S/C31H38F3N5O3/c1-21(40)37-15-11-26(12-16-37)35-27-13-17-38(19-27)30(42)39-18-14-28(20-39)36(2)29(41)24-5-3-22(4-6-24)23-7-9-25(10-8-23)31(32,33)34/h3-10,26-28,35H,11-20H2,1-2H3/t27-,28+/m1/s1 | Reactome pathway
KEGG
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 21 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Neurocrine Biosciences Inc.
Curated by ChEMBL
| Assay Description
Displacement of [125I-Tyr13]MCH from human MCHR1 expressed in HEK293 cells |
Bioorg Med Chem Lett 16: 4450-7 (2006)
Article DOI: 10.1016/j.bmcl.2006.06.045
BindingDB Entry DOI: 10.7270/Q23J3CKC |
More data for this
Ligand-Target Pair | |
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