BDBM50507479 CHEMBL4447260

SMILES COc1cc(OCCn2ccnc2)cc(\C=C\c2cccs2)c1

InChI Key InChIKey=UYJCKUDQQJLXIS-UHFFFAOYSA-N

Data  3 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 50507479   

TargetCytochrome P450 1A2(Human)
Seoul National University

Curated by ChEMBL
LigandPNGBDBM50507479(CHEMBL4447260)
Affinity DataIC50: 1.5nMAssay Description:Inhibition of recombinant human CYP1A2 expressed in Escherichia coli membranes co-expressing NADPH-P450 reductase assessed as reduction in ethoxyreso...More data for this Ligand-Target Pair
In Depth
Date in BDB:
2/19/2021
Entry Details Article
PubMed
TargetCytochrome P450 1B1(Human)
Seoul National University

Curated by ChEMBL
LigandPNGBDBM50507479(CHEMBL4447260)
Affinity DataIC50: 4nMAssay Description:Inhibition of recombinant human CYP1B1 expressed in Escherichia coli membranes co-expressing NADPH-P450 reductase assessed as reduction in ethoxyreso...More data for this Ligand-Target Pair
In Depth
Date in BDB:
2/19/2021
Entry Details Article
PubMed
TargetCytochrome P450 1A1(Human)
Seoul National University

Curated by ChEMBL
LigandPNGBDBM50507479(CHEMBL4447260)
Affinity DataIC50: 41nMAssay Description:Inhibition of recombinant human CYP1A1 expressed in Escherichia coli membranes co-expressing NADPH-P450 reductase assessed as reduction in ethoxyreso...More data for this Ligand-Target Pair
In Depth
Date in BDB:
2/19/2021
Entry Details Article
PubMed