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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'D(1B) dopamine receptor' and Ligand = 'BDBM38950'   
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
D(1B) dopamine receptor


(Homo sapiens (Human))		BDBM38950
PNG
(MLS000056567 | N-[2-(3,4-dimethoxyphenyl)ethyl]-5-...)
Show SMILES COc1ccc(CCNc2nnc(Sc3nnnn3-c3ccccc3)s2)cc1OC
Show InChI InChI=1S/C19H19N7O2S2/c1-27-15-9-8-13(12-16(15)28-2)10-11-20-17-21-23-19(29-17)30-18-22-24-25-26(18)14-6-4-3-5-7-14/h3-9,12H,10-11H2,1-2H3,(H,20,21)
PDB

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PC cid
PC sid
UniChem
PCBioAssay
n/an/an/an/a 0.0113n/an/an/an/a



Vanderbilt Screening Center for GPCRs, Ion Channels and Transporters

Curated by PubChem BioAssay


Assay Description
Assay Provider: Val Watts Assay Provider Affiliation: Purdue University Grant Title: Allosteric Modulators of D1 Receptors Grant Number: 1 X01 MH0776...

PubChem Bioassay (2007)


BindingDB Entry DOI: 10.7270/Q2MW2FJG
More data for this
Ligand-Target Pair