BDBM50515949 CHEMBL4525382

SMILES COc1cc(\C=C\C(=O)OCCCN(C)C[C@@H](C)COC(=O)c2c3ccccc3cc3ccccc23)cc(OC)c1OC

InChI Key InChIKey=IKLFQSCVNJUBQF-UHFFFAOYSA-N

Data  2 EC50

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50515949   

TargetATP-dependent translocase ABCB1(Human)
University of Florence

Curated by ChEMBL

LigandBDBM50515949(CHEMBL4525382)Copy SMILESCopy InChI

Affinity DataEC50:  960nMAssay Description:Inhibition of P-gp (unknown origin) expressed in MDCK-MDR1 cells assessed as increase in calcein-AM accumulation incubated for 30 mins by calcein-AM ...More data for this Ligand-Target Pair

Target InfoPDB
UniProtKB/SwissProt
GoogleScholar

Ligand InfoPC cidPC sidSimilars

In Depth
Date in BDB:
2/22/2021
Entry Details Article
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TargetBroad substrate specificity ATP-binding cassette transporter ABCG2(Human)
University of Florence

Curated by ChEMBL

LigandBDBM50515949(CHEMBL4525382)Copy SMILESCopy InChI

Affinity DataEC50:  6.80E+3nMAssay Description:Inhibition of BCRP (unknown origin) expressed in MDCK cells assessed as increase in Hoechst 33342 accumulation incubated for 30 mins by Hoechst 33342...More data for this Ligand-Target Pair

Target InfoPDBKEGG
UniProtKB/SwissProt
GoogleScholar

Ligand InfoPC cidPC sidSimilars

In Depth
Date in BDB:
2/22/2021
Entry Details Article
Copy BDB DOIPubMed
Copy reaction URL