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BDBM50186866 CHEMBL211792::N-{(R)-1-(4-chloro-benzyl)-2-[4-(4-isobutyl-1,1-dioxo-hexahydrothiopyran-4-yl)-piperazin-1-yl]-2-oxo-ethyl}-2-(2,3-dihydro-1H-isoindol-1-yl)-acetamide trifluoroacetic acid

SMILES: CC(C)CC1(CCS(=O)(=O)CC1)N1CCN(CC1)C(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)CC1NCc2ccccc12

InChI Key: InChIKey=OKDLDIPTQLRFQX-YPJJGMIRSA-N

Data: 1 KI

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50186866   
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
Melanocortin receptor 4


(Homo sapiens (Human))		BDBM50186866
PNG
(CHEMBL211792 | N-{(R)-1-(4-chloro-benzyl)-2-[4-(4-...)
Show SMILES CC(C)CC1(CCS(=O)(=O)CC1)N1CCN(CC1)C(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)CC1NCc2ccccc12
Show InChI InChI=1S/C32H43ClN4O4S/c1-23(2)21-32(11-17-42(40,41)18-12-32)37-15-13-36(14-16-37)31(39)29(19-24-7-9-26(33)10-8-24)35-30(38)20-28-27-6-4-3-5-25(27)22-34-28/h3-10,23,28-29,34H,11-22H2,1-2H3,(H,35,38)/t28?,29-/m1/s1
PDB

KEGG

UniProtKB/SwissProt

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PC cid
PC sid
UniChem

Similars
Article
PubMed
 76n/an/an/an/an/an/an/an/a



Lilly Research Laboratories

Curated by ChEMBL


Assay Description
Displacement of [125I]NDP-alpha-MSH from human MC4 receptor transfected in HEK293 cells

Bioorg Med Chem Lett 16: 3843-6 (2006)


Article DOI: 10.1016/j.bmcl.2006.04.016
BindingDB Entry DOI: 10.7270/Q2SQ900D
More data for this
Ligand-Target Pair