BDBM50235780 (4-(2-((S)-1-amino-2-methylpropyl)-6-fluorophenyl)piperazin-1-yl)(3-(2,4-dichlorophenyl)pyrrolidin-2-yl)methanone::CHEMBL402587

SMILES: CC(C)[C@H](N)c1cccc(F)c1N1CCN(CC1)C(=O)C1NCCC1c1ccc(Cl)cc1Cl

InChI Key: InChIKey=DMNMGAOYTCAYCS-PHBIXPCASA-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 = 50235780   

Target/Host (Institution)	Ligand	Target/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	pH	Temp °C
Melanocortin receptor 4 (Homo sapiens (Human))	BDBM50235780 ((4-(2-((S)-1-amino-2-methylpropyl)-6-fluorophenyl)...) Show SMILES CC(C)[C@H](N)c1cccc(F)c1N1CCN(CC1)C(=O)C1NCCC1c1ccc(Cl)cc1Cl |w:24.27,20.21| Show InChI InChI=1S/C25H31Cl2FN4O/c1-15(2)22(29)19-4-3-5-21(28)24(19)31-10-12-32(13-11-31)25(33)23-18(8-9-30-23)17-7-6-16(26)14-20(17)27/h3-7,14-15,18,22-23,30H,8-13,29H2,1-2H3/t18?,22-,23?/m0/s1	PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	560	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/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
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