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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Substance-P receptor' and Ligand = 'BDBM50030198'   
Target/Host
(Institution)		LigandTarget/Host
Links		Ligand
Links		Trg + Lig
Links		Ki
nM		ΔG°
kJ/mole		IC50
nM		Kd
nM		EC50/IC50
nM		koff
s-1		kon
M-1s-1		pHTemp
°C
Substance-P receptor


(GUINEA PIG)		BDBM50030198
PNG
((R)-1-(Benzo[b]thiophene-2-carbonyl)-4-hydroxy-pyr...)
Show SMILES CN(Cc1ccccc1)C(=O)[C@@H](Cc1ccccc1)NC(=O)C1C[C@@H](O)CN1C(=O)c1cc2ccccc2s1
Show InChI InChI=1S/C31H31N3O4S/c1-33(19-22-12-6-3-7-13-22)30(37)25(16-21-10-4-2-5-11-21)32-29(36)26-18-24(35)20-34(26)31(38)28-17-23-14-8-9-15-27(23)39-28/h2-15,17,24-26,35H,16,18-20H2,1H3,(H,32,36)/t24-,25-,26?/m1/s1
PDB
MMDB

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
PubMed
n/an/a 20n/an/an/an/an/an/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
More data for this
Ligand-Target Pair