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BDBM50134499 (R)-1,2,3,4-Tetrahydro-isoquinoline-3-carboxylic acid {(R)-1-(4-chloro-benzyl)-2-[4-(2-{[(1-ethyl-propyl)-methanesulfonyl-amino]-methyl}-phenyl)-piperazin-1-yl]-2-oxo-ethyl}-amide::CHEMBL339708

SMILES: CCC(CC)N(Cc1ccccc1N1CCN(CC1)C(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)[C@H]1Cc2ccccc2CN1)S(C)(=O)=O

InChI Key: InChIKey=BPURAFMVJKOCRE-CZNDPXEESA-N

Data: 1 EC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50134499   
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))		BDBM50134499
PNG
((R)-1,2,3,4-Tetrahydro-isoquinoline-3-carboxylic a...)
Show SMILES CCC(CC)N(Cc1ccccc1N1CCN(CC1)C(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)[C@H]1Cc2ccccc2CN1)S(C)(=O)=O
Show InChI InChI=1S/C36H46ClN5O4S/c1-4-31(5-2)42(47(3,45)46)25-29-12-8-9-13-34(29)40-18-20-41(21-19-40)36(44)33(22-26-14-16-30(37)17-15-26)39-35(43)32-23-27-10-6-7-11-28(27)24-38-32/h6-17,31-33,38H,4-5,18-25H2,1-3H3,(H,39,43)/t32-,33-/m1/s1
PDB

KEGG

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars
PubMed
n/an/an/an/a 2.20E+3n/an/an/an/a



Neurocrine Biosciences Inc.

Curated by ChEMBL


Assay Description
Agonistic activity measured as inhibition of cAMP accumulation in HEK cells expressing human Melanocortin 4 receptor (hMC4R)

Bioorg Med Chem Lett 13: 3793-6 (2003)


BindingDB Entry DOI: 10.7270/Q2P26ZNW
More data for this
Ligand-Target Pair