BindingDB logo
myBDB logout

BDBM50235777 5-(1-(2-((S)-1-amino-3-methylbutyl)-4-(trifluoromethyl)phenyl)piperazine-4-carbonyl)-4-(4-chlorophenyl)pyrrolidin-2-one::CHEMBL401797

SMILES: CC(C)C[C@H](N)c1cc(ccc1N1CCN(CC1)C(=O)C1NC(=O)CC1c1ccc(Cl)cc1)C(F)(F)F

InChI Key: InChIKey=WQBDGDLBEOMMMM-CVCZCXRASA-N

Data: 1 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 1 hit for monomerid = 50235777   
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))		BDBM50235777
PNG
(5-(1-(2-((S)-1-amino-3-methylbutyl)-4-(trifluorome...)
Show SMILES CC(C)C[C@H](N)c1cc(ccc1N1CCN(CC1)C(=O)C1NC(=O)CC1c1ccc(Cl)cc1)C(F)(F)F |w:20.21,25.28|
Show InChI InChI=1S/C27H32ClF3N4O2/c1-16(2)13-22(32)21-14-18(27(29,30)31)5-8-23(21)34-9-11-35(12-10-34)26(37)25-20(15-24(36)33-25)17-3-6-19(28)7-4-17/h3-8,14,16,20,22,25H,9-13,15,32H2,1-2H3,(H,33,36)/t20?,22-,25?/m0/s1
PDB

KEGG

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars
Article
PubMed
 340n/an/an/an/an/an/an/an/a



Neurocrine Biosciences, Inc.

Curated by ChEMBL


Assay Description
Displacement of [125]NDPMSH from human MC4 receptor expressed in HEK293 cells

Bioorg Med Chem Lett 18: 1931-8 (2008)


Article DOI: 10.1016/j.bmcl.2008.01.125
BindingDB Entry DOI: 10.7270/Q2WD409C
More data for this
Ligand-Target Pair