BDBM50115965 2-[(3,5-Bis-trifluoromethyl-benzoyl)-methyl-amino]-4'-chloro-biphenyl-4-carboxylic acid (3-dimethylamino-propyl)-amide::CHEMBL62679

SMILES: CN(C)CCCNC(=O)c1ccc(-c2ccc(Cl)cc2)c(c1)N(C)C(=O)c1cc(cc(c1)C(F)(F)F)C(F)(F)F

InChI Key: InChIKey=SDTLZBKGRGUYBM-UHFFFAOYSA-N

Data: 2 IC50

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 = 50115965   

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
Neurokinin 2 receptor (Homo sapiens (Human))	BDBM50115965 (2-[(3,5-Bis-trifluoromethyl-benzoyl)-methyl-amino]...) Show SMILES CN(C)CCCNC(=O)c1ccc(-c2ccc(Cl)cc2)c(c1)N(C)C(=O)c1cc(cc(c1)C(F)(F)F)C(F)(F)F Show InChI InChI=1S/C28H26ClF6N3O2/c1-37(2)12-4-11-36-25(39)18-7-10-23(17-5-8-22(29)9-6-17)24(15-18)38(3)26(40)19-13-20(27(30,31)32)16-21(14-19)28(33,34)35/h5-10,13-16H,4,11-12H2,1-3H3,(H,36,39)	Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	108	n/a	n/a	n/a	n/a	n/a	n/a
Novartis Pharma AG Curated by ChEMBL					Assay Description Binding affinity was determined by measuring the inhibition of 125 I-NKA binding to transfected CHO-cells expressing human recombinant Tachykinin rec...				Bioorg Med Chem Lett 12: 2065-8 (2002) BindingDB Entry DOI: 10.7270/Q2K64HD2
					More data for this Ligand-Target Pair
Neurokinin 1 receptor (Homo sapiens (Human))	BDBM50115965 (2-[(3,5-Bis-trifluoromethyl-benzoyl)-methyl-amino]...) Show SMILES CN(C)CCCNC(=O)c1ccc(-c2ccc(Cl)cc2)c(c1)N(C)C(=O)c1cc(cc(c1)C(F)(F)F)C(F)(F)F Show InChI InChI=1S/C28H26ClF6N3O2/c1-37(2)12-4-11-36-25(39)18-7-10-23(17-5-8-22(29)9-6-17)24(15-18)38(3)26(40)19-13-20(27(30,31)32)16-21(14-19)28(33,34)35/h5-10,13-16H,4,11-12H2,1-3H3,(H,36,39)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	1	n/a	n/a	n/a	n/a	n/a	n/a
Novartis Pharma AG Curated by ChEMBL					Assay Description inhibition of [3H]-Sar-SP binding to Tachykinin receptor 1 of bovine retina membranes				Bioorg Med Chem Lett 12: 2065-8 (2002) BindingDB Entry DOI: 10.7270/Q2K64HD2
					More data for this Ligand-Target Pair