BDBM50217090 CHEMBL321098

SMILES:

InChI Key: InChIKey=FTFGWRNMMHQZBL-UHFFFAOYSA-N

Data: 1 KI

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 = 50217090   

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))	BDBM50217090 (CHEMBL321098) Show SMILES Show InChI InChI=1S/C33H29F6N3O7S/c1-48-23-8-9-25(49-2)26(17-23)50(46,47)40-12-10-31(11-13-40)27-24(29(44)42(30(27)45)22-6-4-3-5-7-22)18-41(31)28(43)19-14-20(32(34,35)36)16-21(15-19)33(37,38)39/h3-9,14-17,24,27H,10-13,18H2,1-2H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	PubMed	30	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
F. Hoffmann-La Roche AG Curated by ChEMBL					Assay Description Affinity for human Tachykinin receptor 1 expressed in CHO cells				Bioorg Med Chem Lett 12: 3073-6 (2002) BindingDB Entry DOI: 10.7270/Q23N25J3
					More data for this Ligand-Target Pair