BDBM50140775 4-Phenyl-quinoline-3-carboxylic acid 3,5-bis-trifluoromethyl-benzylamide::CHEMBL24894

SMILES: FC(F)(F)c1cc(CNC(=O)c2cnc3ccccc3c2-c2ccccc2)cc(c1)C(F)(F)F

InChI Key: InChIKey=OITQQVPZHBLPSD-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 = 50140775   

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 1 receptor (Homo sapiens (Human))	BDBM50140775 (4-Phenyl-quinoline-3-carboxylic acid 3,5-bis-trifl...) Show SMILES FC(F)(F)c1cc(CNC(=O)c2cnc3ccccc3c2-c2ccccc2)cc(c1)C(F)(F)F Show InChI InChI=1S/C25H16F6N2O/c26-24(27,28)17-10-15(11-18(12-17)25(29,30)31)13-33-23(34)20-14-32-21-9-5-4-8-19(21)22(20)16-6-2-1-3-7-16/h1-12,14H,13H2,(H,33,34)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	208	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ degli Studi di Siena Curated by ChEMBL					Assay Description Displacement of [125I]BH-SP from human recombinant NK1 receptor expressed in CHO cells after 90 mins				Bioorg Med Chem 19: 2242-51 (2011) Article DOI: 10.1016/j.bmc.2011.02.031 BindingDB Entry DOI: 10.7270/Q2QJ7J8H
					More data for this Ligand-Target Pair
Neurokinin 1 receptor (Homo sapiens (Human))	BDBM50140775 (4-Phenyl-quinoline-3-carboxylic acid 3,5-bis-trifl...) Show SMILES FC(F)(F)c1cc(CNC(=O)c2cnc3ccccc3c2-c2ccccc2)cc(c1)C(F)(F)F Show InChI InChI=1S/C25H16F6N2O/c26-24(27,28)17-10-15(11-18(12-17)25(29,30)31)13-33-23(34)20-14-32-21-9-5-4-8-19(21)22(20)16-6-2-1-3-7-16/h1-12,14H,13H2,(H,33,34)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>1.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
Università degli Studi di Siena Curated by ChEMBL					Assay Description Binding affinity against human Tachykinin receptor 1 expressed in astrocytoma UC11MG cells using [125I]- SP radioligand				J Med Chem 47: 1315-8 (2004) Article DOI: 10.1021/jm034219a BindingDB Entry DOI: 10.7270/Q2F76C0W
					More data for this Ligand-Target Pair