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BDBM50174823 CHEMBL198968::N-[(R)-1-(3'-cyano-biphenyl-4-yl)-ethyl]-N-[(3,5-dichloro-phenylcarbamoyl)-methyl]-3-((S)-3-hydroxy-pyrrolidin-1-yl)-propionamide

SMILES: C[C@@H](N(CC(=O)Nc1cc(Cl)cc(Cl)c1)C(=O)CCN1CC[C@H](O)C1)c1ccc(cc1)-c1cccc(c1)C#N

InChI Key: InChIKey=MIZWJDQIHFJVAY-NGOKVRLYSA-N

Data: 2 KI

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50174823   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Melanin-concentrating hormone receptor


(Homo sapiens (Human))
BDBM50174823
PNG
(CHEMBL198968 | N-[(R)-1-(3'-cyano-biphenyl-4-yl)-e...)
Show SMILES C[C@@H](N(CC(=O)Nc1cc(Cl)cc(Cl)c1)C(=O)CCN1CC[C@H](O)C1)c1ccc(cc1)-c1cccc(c1)C#N
Show InChI InChI=1S/C30H30Cl2N4O3/c1-20(22-5-7-23(8-6-22)24-4-2-3-21(13-24)17-33)36(30(39)10-12-35-11-9-28(37)18-35)19-29(38)34-27-15-25(31)14-26(32)16-27/h2-8,13-16,20,28,37H,9-12,18-19H2,1H3,(H,34,38)/t20-,28+/m1/s1
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PC cid
PC sid
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Similars

Article
PubMed
23n/an/an/an/an/an/an/an/a



Schering-Plough Research Institute

Curated by ChEMBL


Assay Description
Antagonist activity against human MCH1 receptor


Bioorg Med Chem Lett 15: 5234-6 (2005)


Article DOI: 10.1016/j.bmcl.2005.08.043
BindingDB Entry DOI: 10.7270/Q24F1Q80
More data for this
Ligand-Target Pair
GPR145


(Homo sapiens (Human))
BDBM50174823
PNG
(CHEMBL198968 | N-[(R)-1-(3'-cyano-biphenyl-4-yl)-e...)
Show SMILES C[C@@H](N(CC(=O)Nc1cc(Cl)cc(Cl)c1)C(=O)CCN1CC[C@H](O)C1)c1ccc(cc1)-c1cccc(c1)C#N
Show InChI InChI=1S/C30H30Cl2N4O3/c1-20(22-5-7-23(8-6-22)24-4-2-3-21(13-24)17-33)36(30(39)10-12-35-11-9-28(37)18-35)19-29(38)34-27-15-25(31)14-26(32)16-27/h2-8,13-16,20,28,37H,9-12,18-19H2,1H3,(H,34,38)/t20-,28+/m1/s1
Reactome pathway
KEGG

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
>3.00E+3n/an/an/an/an/an/an/an/a



Schering-Plough Research Institute

Curated by ChEMBL


Assay Description
Antagonist activity against human MCH2 receptor


Bioorg Med Chem Lett 15: 5234-6 (2005)


Article DOI: 10.1016/j.bmcl.2005.08.043
BindingDB Entry DOI: 10.7270/Q24F1Q80
More data for this
Ligand-Target Pair