BDBM50323448 (3S,4R)-tert-butyl 3-((S)-6-chloro-3-(2-cyanopropan-2-yl)-5-methyl-3H-spiro[isobenzofuran-1,4'-piperidine]-1'-ylcarbonyl)-4-(2,4-difluorophenyl)pyrrolidine-1-carboxylate::CHEMBL1209705

SMILES: Cc1cc2[C@H](OC3(CCN(CC3)C(=O)[C@@H]3CN(C[C@H]3c3ccc(F)cc3F)C(=O)OC(C)(C)C)c2cc1Cl)C(C)(C)C#N

InChI Key: InChIKey=KAYGSPNQAOWJST-JPYHZWLXSA-N

Data: 1 IC50  1 EC50

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 2 hits for monomerid = 50323448   

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))	BDBM50323448 ((3S,4R)-tert-butyl 3-((S)-6-chloro-3-(2-cyanopropa...) Show SMILES Cc1cc2[C@H](OC3(CCN(CC3)C(=O)[C@@H]3CN(C[C@H]3c3ccc(F)cc3F)C(=O)OC(C)(C)C)c2cc1Cl)C(C)(C)C#N |r| Show InChI InChI=1S/C33H38ClF2N3O4/c1-19-13-22-25(15-26(19)34)33(42-28(22)32(5,6)18-37)9-11-38(12-10-33)29(40)24-17-39(30(41)43-31(2,3)4)16-23(24)21-8-7-20(35)14-27(21)36/h7-8,13-15,23-24,28H,9-12,16-17H2,1-6H3/t23-,24+,28-/m0/s1	PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	1.01E+3	n/a	n/a	n/a	n/a
Merck Research Laboratories Curated by ChEMBL					Assay Description Agonist activity at human melanocortin 4 receptor expressed in CHO cells assessed as cAMP release				Bioorg Med Chem Lett 20: 4895-900 (2010) Article DOI: 10.1016/j.bmcl.2010.06.068 BindingDB Entry DOI: 10.7270/Q2TB172P
					More data for this Ligand-Target Pair
Melanocortin receptor 4 (Homo sapiens (Human))	BDBM50323448 ((3S,4R)-tert-butyl 3-((S)-6-chloro-3-(2-cyanopropa...) Show SMILES Cc1cc2[C@H](OC3(CCN(CC3)C(=O)[C@@H]3CN(C[C@H]3c3ccc(F)cc3F)C(=O)OC(C)(C)C)c2cc1Cl)C(C)(C)C#N |r| Show InChI InChI=1S/C33H38ClF2N3O4/c1-19-13-22-25(15-26(19)34)33(42-28(22)32(5,6)18-37)9-11-38(12-10-33)29(40)24-17-39(30(41)43-31(2,3)4)16-23(24)21-8-7-20(35)14-27(21)36/h7-8,13-15,23-24,28H,9-12,16-17H2,1-6H3/t23-,24+,28-/m0/s1	PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	479	n/a	n/a	n/a	n/a	n/a	n/a
Merck Research Laboratories Curated by ChEMBL					Assay Description Displacement of [125I]NDP-alpha-MSH from human melanocortin 4 receptor expressed in CHO cells				Bioorg Med Chem Lett 20: 4895-900 (2010) Article DOI: 10.1016/j.bmcl.2010.06.068 BindingDB Entry DOI: 10.7270/Q2TB172P
					More data for this Ligand-Target Pair