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BDBM50088507 CHEBI:63804::CHEMBL1908021

SMILES: Oc1ccc(cc1)C1(NC(=O)NC1=O)c1ccccc1

InChI Key: InChIKey=XEEDURHPFVXALT-UHFFFAOYSA-N

Data: 6 IC50

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 6 hits for monomerid = 50088507   
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
Uridine-5'-diphosphoglucuronosyltransferase 1A1


(Homo sapiens (Human))
BDBM50088507
PNG
(CHEBI:63804 | CHEMBL1908021)
Show SMILES Oc1ccc(cc1)C1(NC(=O)NC1=O)c1ccccc1
Show InChI InChI=1S/C15H12N2O3/c18-12-8-6-11(7-9-12)15(10-4-2-1-3-5-10)13(19)16-14(20)17-15/h1-9,18H,(H2,16,17,19,20)
UniProtKB/SwissProt
UniProtKB/TrEMBL

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CHEMBL
MCE
PC cid
PC sid
UniChem

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Article
PubMed
n/an/a 1.10E+5n/an/an/an/an/an/a



University of Minnesota

Curated by ChEMBL


Assay Description
Inhibition of human recombinant UGT1A1 expressed in HEK293 cells assessed as reduction in estradiol 3-glucuronidation by LC-MS/MS method


Drug Metab Dispos 39: 322-9 (2011)


Article DOI: 10.1124/dmd.110.035030
BindingDB Entry DOI: 10.7270/Q2PC343R
More data for this
Ligand-Target Pair
Uridine-5'-diphosphoglucuronosyltransferase 1A1


(Homo sapiens (Human))
BDBM50088507
PNG
(CHEBI:63804 | CHEMBL1908021)
Show SMILES Oc1ccc(cc1)C1(NC(=O)NC1=O)c1ccccc1
Show InChI InChI=1S/C15H12N2O3/c18-12-8-6-11(7-9-12)15(10-4-2-1-3-5-10)13(19)16-14(20)17-15/h1-9,18H,(H2,16,17,19,20)
UniProtKB/SwissProt
UniProtKB/TrEMBL

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CHEMBL
MCE
PC cid
PC sid
UniChem

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Article
PubMed
n/an/a 1.20E+5n/an/an/an/an/an/a



University of Minnesota

Curated by ChEMBL


Assay Description
Inhibition of human recombinant UGT1A1 expressed in HEK293 cells assessed as reduction in bilirubin glucuronidation by LC-MS/MS method


Drug Metab Dispos 39: 322-9 (2011)


Article DOI: 10.1124/dmd.110.035030
BindingDB Entry DOI: 10.7270/Q2PC343R
More data for this
Ligand-Target Pair
Aldose reductase


(Homo sapiens (Human))
BDBM50088507
PNG
(CHEBI:63804 | CHEMBL1908021)
Show SMILES Oc1ccc(cc1)C1(NC(=O)NC1=O)c1ccccc1
Show InChI InChI=1S/C15H12N2O3/c18-12-8-6-11(7-9-12)15(10-4-2-1-3-5-10)13(19)16-14(20)17-15/h1-9,18H,(H2,16,17,19,20)
PDB

UniProtKB/SwissProt
UniProtKB/TrEMBL

antibodypedia
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CHEMBL
MCE
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PubMed
n/an/a 6.42E+4n/an/an/an/an/an/a



Kyushu University

Curated by ChEMBL


Assay Description
Inhibition of human Protein kinase C delta


Bioorg Med Chem Lett 30: (2020)

More data for this
Ligand-Target Pair
Aldose reductase


(Homo sapiens (Human))
BDBM50088507
PNG
(CHEBI:63804 | CHEMBL1908021)
Show SMILES Oc1ccc(cc1)C1(NC(=O)NC1=O)c1ccccc1
Show InChI InChI=1S/C15H12N2O3/c18-12-8-6-11(7-9-12)15(10-4-2-1-3-5-10)13(19)16-14(20)17-15/h1-9,18H,(H2,16,17,19,20)
PDB

UniProtKB/SwissProt
UniProtKB/TrEMBL

antibodypedia
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CHEMBL
MCE
PC cid
PC sid
UniChem

Similars

PubMed
n/an/a 4.79E+4n/an/an/an/an/an/a



Kyushu University

Curated by ChEMBL


Assay Description
Inhibition of protein kinase C epsilon expressed in Sf-9 cells


Bioorg Med Chem Lett 30: (2020)

More data for this
Ligand-Target Pair
Aldose reductase


(Homo sapiens (Human))
BDBM50088507
PNG
(CHEBI:63804 | CHEMBL1908021)
Show SMILES Oc1ccc(cc1)C1(NC(=O)NC1=O)c1ccccc1
Show InChI InChI=1S/C15H12N2O3/c18-12-8-6-11(7-9-12)15(10-4-2-1-3-5-10)13(19)16-14(20)17-15/h1-9,18H,(H2,16,17,19,20)
PDB

UniProtKB/SwissProt
UniProtKB/TrEMBL

antibodypedia
GoogleScholar
AffyNet 
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CHEMBL
MCE
PC cid
PC sid
UniChem

Similars

PubMed
n/an/a 4.06E+4n/an/an/an/an/an/a



Kyushu University

Curated by ChEMBL


Assay Description
Inhibition of human Protein kinase C beta 1


Bioorg Med Chem Lett 30: (2020)

More data for this
Ligand-Target Pair
Aldose reductase


(Homo sapiens (Human))
BDBM50088507
PNG
(CHEBI:63804 | CHEMBL1908021)
Show SMILES Oc1ccc(cc1)C1(NC(=O)NC1=O)c1ccccc1
Show InChI InChI=1S/C15H12N2O3/c18-12-8-6-11(7-9-12)15(10-4-2-1-3-5-10)13(19)16-14(20)17-15/h1-9,18H,(H2,16,17,19,20)
PDB

UniProtKB/SwissProt
UniProtKB/TrEMBL

antibodypedia
GoogleScholar
AffyNet 
Purchase

CHEMBL
MCE
PC cid
PC sid
UniChem

Similars

PubMed
n/an/a 4.06E+4n/an/an/an/an/an/a



Kyushu University

Curated by ChEMBL


Assay Description
Inhibition of protein kinase C epsilon expressed in Sf-9 cells


Bioorg Med Chem Lett 30: (2020)

More data for this
Ligand-Target Pair