null

SMILES: C[C@H](C[C@@H](NC(C)=O)N1CCC[C@@H](Cc2ccc(F)cc2)C1)NC(=O)Nc1cccc(c1)-c1nnnn1C

InChI Key: InChIKey=JTRFENATSPZVNG-QLWBXOBMSA-N

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50372846   

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
Cytochrome P450 2D6 (Homo sapiens (Human))	BDBM50372846 (CHEMBL404586) Show SMILES C[C@H](C[C@@H](NC(C)=O)N1CCC[C@@H](Cc2ccc(F)cc2)C1)NC(=O)Nc1cccc(c1)-c1nnnn1C Show InChI InChI=1S/C27H35FN8O2/c1-18(29-27(38)31-24-8-4-7-22(16-24)26-32-33-34-35(26)3)14-25(30-19(2)37)36-13-5-6-21(17-36)15-20-9-11-23(28)12-10-20/h4,7-12,16,18,21,25H,5-6,13-15,17H2,1-3H3,(H,30,37)(H2,29,31,38)/t18-,21+,25+/m1/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3.80E+3	n/a	n/a	n/a	n/a	n/a	n/a
Bristol-Myers Squibb Company Curated by ChEMBL					Assay Description Inhibition of CYP2D6				Bioorg Med Chem Lett 18: 576-85 (2008) Article DOI: 10.1016/j.bmcl.2007.11.067 BindingDB Entry DOI: 10.7270/Q2057GS3
					More data for this Ligand-Target Pair
C-C chemokine receptor type 3 (Homo sapiens (Human))	BDBM50372846 (CHEMBL404586) Show SMILES C[C@H](C[C@@H](NC(C)=O)N1CCC[C@@H](Cc2ccc(F)cc2)C1)NC(=O)Nc1cccc(c1)-c1nnnn1C Show InChI InChI=1S/C27H35FN8O2/c1-18(29-27(38)31-24-8-4-7-22(16-24)26-32-33-34-35(26)3)14-25(30-19(2)37)36-13-5-6-21(17-36)15-20-9-11-23(28)12-10-20/h4,7-12,16,18,21,25H,5-6,13-15,17H2,1-3H3,(H,30,37)(H2,29,31,38)/t18-,21+,25+/m1/s1	Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	0.600	n/a	n/a	n/a	n/a	n/a	n/a
Bristol-Myers Squibb Company Curated by ChEMBL					Assay Description Displacement of [125I]eotaxin from human CCR3 receptor expressed in CHO cells				Bioorg Med Chem Lett 18: 576-85 (2008) Article DOI: 10.1016/j.bmcl.2007.11.067 BindingDB Entry DOI: 10.7270/Q2057GS3
					More data for this Ligand-Target Pair