BDBM50030176 CHEMBL65703::N*1*-[(R)-1-(Benzyl-methyl-carbamoyl)-2-phenyl-ethyl]-2-[(1H-indole-3-carbonyl)-amino]-succinamide

SMILES: CN(Cc1ccccc1)C(=O)[C@@H](Cc1ccccc1)NC(=O)C(CC(N)=O)NC(=O)c1c[nH]c2ccccc12

InChI Key: InChIKey=KLRWSWANHXZVMX-FXDYGKIASA-N

Data: 1 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 1 hit for monomerid = 50030176   

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 (GUINEA PIG)	BDBM50030176 (CHEMBL65703 | N*1*-[(R)-1-(Benzyl-methyl-carbamoyl...) Show SMILES CN(Cc1ccccc1)C(=O)[C@@H](Cc1ccccc1)NC(=O)C(CC(N)=O)NC(=O)c1c[nH]c2ccccc12 Show InChI InChI=1S/C30H31N5O4/c1-35(19-21-12-6-3-7-13-21)30(39)26(16-20-10-4-2-5-11-20)34-29(38)25(17-27(31)36)33-28(37)23-18-32-24-15-9-8-14-22(23)24/h2-15,18,25-26,32H,16-17,19H2,1H3,(H2,31,36)(H,33,37)(H,34,38)/t25?,26-/m1/s1	PDB MMDB UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	9	n/a	n/a	n/a	n/a	n/a	n/a
Fujisawa Pharmaceutical Co., Ltd. Curated by ChEMBL					Assay Description In vitro binding affinity against substance P receptor using [3H]SP as radioligand in guinea pig lung membrane				J Med Chem 37: 2090-9 (1994) BindingDB Entry DOI: 10.7270/Q23779BT
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