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BDBM50245370 (2R)-1-(4-(2-(1-amino-3-methylbutyl)phenyl)piperazin-1-yl)-2-(bis(cyclopropylmethyl)amino)-3-(2,4-dichlorophenyl)propan-1-one::CHEMBL515512

SMILES: CC(C)CC(N)c1ccccc1N1CCN(CC1)C(=O)[C@@H](Cc1ccc(Cl)cc1Cl)N(CC1CC1)CC1CC1

InChI Key: InChIKey=BJXWSENRSPUNDR-ZGVDRVBQSA-N

Data: 1 KI

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Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50245370   
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))
BDBM50245370
PNG
((2R)-1-(4-(2-(1-amino-3-methylbutyl)phenyl)piperaz...)
Show SMILES CC(C)CC(N)c1ccccc1N1CCN(CC1)C(=O)[C@@H](Cc1ccc(Cl)cc1Cl)N(CC1CC1)CC1CC1
Show InChI InChI=1S/C32H44Cl2N4O/c1-22(2)17-29(35)27-5-3-4-6-30(27)36-13-15-37(16-14-36)32(39)31(18-25-11-12-26(33)19-28(25)34)38(20-23-7-8-23)21-24-9-10-24/h3-6,11-12,19,22-24,29,31H,7-10,13-18,20-21,35H2,1-2H3/t29?,31-/m1/s1
KEGG

UniProtKB/SwissProt

GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
350n/an/an/an/an/an/an/an/a



Neurocrine Biosciences, Inc.

Curated by ChEMBL


Assay Description
Binding affinity to human MC4 receptor


Bioorg Med Chem Lett 18: 4817-22 (2008)


Article DOI: 10.1016/j.bmcl.2008.07.076
BindingDB Entry DOI: 10.7270/Q24T6J75
More data for this
Ligand-Target Pair