BDBM50030233 (S)-((S)-8-Benzhydryl-7-aza-tricyclo[4.3.1.0*3,7*]dec-9-yl)-(2-chloro-benzyl)-amine::CHEMBL319559

SMILES: Clc1ccccc1CNC1C2CC3CCC(C2)N3[C@H]1C(c1ccccc1)c1ccccc1

InChI Key: InChIKey=KKCRDTKEJOJYRG-YQOMSNACSA-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 = 50030233   

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))	BDBM50030233 ((S)-((S)-8-Benzhydryl-7-aza-tricyclo[4.3.1.0*3,7*]...) Show SMILES Clc1ccccc1CNC1C2CC3CCC(C2)N3[C@H]1C(c1ccccc1)c1ccccc1 |TLB:13:12:18.9:15.16| Show InChI InChI=1S/C29H31ClN2/c30-26-14-8-7-13-22(26)19-31-28-23-17-24-15-16-25(18-23)32(24)29(28)27(20-9-3-1-4-10-20)21-11-5-2-6-12-21/h1-14,23-25,27-29,31H,15-19H2/t23?,24?,25?,28?,29-/m0/s1	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	7.10	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer, Inc. Curated by ChEMBL					Assay Description Tested in vitro for the binding affinity towards NK1 receptor in human IM-9 cells using [125I]-labeled bolton-hunter substance P as ligand				J Med Chem 37: 2831-40 (1994) BindingDB Entry DOI: 10.7270/Q2CZ365J
					More data for this Ligand-Target Pair