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Compile Data Set for Download or QSAR

Found 1 hit of ic50 for UniProtKB: P00325   
Target/Host
(Institution)		LigandTarget/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		pHTemp
°C
All-trans-retinol dehydrogenase [NAD(+)] ADH1B


(Homo sapiens (Human))		BDBM50465805
PNG
(CHEMBL4290485)
Show SMILES Clc1cc(ccc1-c1ccc(cc1)-n1ccnc1)-c1nnn[nH]1
Show InChI InChI=1S/C16H11ClN6/c17-15-9-12(16-19-21-22-20-16)3-6-14(15)11-1-4-13(5-2-11)23-8-7-18-10-23/h1-10H,(H,19,20,21,22)
PDB
MMDB

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PC cid
PC sid
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Article
PubMed
n/an/a 5.40E+4n/an/an/an/an/an/a



Glenmark Pharmaceuticals Limited

Curated by ChEMBL


Assay Description
Inhibition of ADH1B (unknown origin) assessed as reduction in NADH production by spectrophotometric analysis

Bioorg Med Chem Lett 28: 3766-3773 (2018)


Article DOI: 10.1016/j.bmcl.2018.10.012
BindingDB Entry DOI: 10.7270/Q21G0PZK
More data for this
Ligand-Target Pair