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Found 1 hit Enz. Inhib. hit(s) with Target = 'ATP-dependent translocase ABCB1' and Ligand = 'BDBM50032251'   
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
ATP-dependent translocase ABCB1


(Homo sapiens (Human))		BDBM50032251
PNG
(CHEMBL3352983)
Show SMILES COc1ccc(cc1)-c1ccc(OCCN2CCc3cc(OC)c(OC)cc3C2)cc1
Show InChI InChI=1S/C26H29NO4/c1-28-23-8-4-19(5-9-23)20-6-10-24(11-7-20)31-15-14-27-13-12-21-16-25(29-2)26(30-3)17-22(21)18-27/h4-11,16-17H,12-15,18H2,1-3H3
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Similars
Article
PubMed
n/an/an/an/a 930n/an/an/an/a



Universit£ degli Studi di Bari"A. Moro"

Curated by ChEMBL


Assay Description
Inhibition of MDR1 (unknown origin) over-expressed in MDCK cells assessed as calcein accumulation incubated for 30 mins prior to Calcein-AM addition ...

J Med Chem 57: 9983-94 (2014)


Article DOI: 10.1021/jm501640e
BindingDB Entry DOI: 10.7270/Q2K9394N
More data for this
Ligand-Target Pair