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Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Cytochrome P450 1A1' and Ligand = 'BDBM50208872'   
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
Cytochrome P450 1A1


(Rattus norvegicus)
BDBM50208872
PNG
(5,6-dimethyl-1H-benzimidazole | 5,6-dimethylbenzim...)
Show SMILES Cc1cc2nc[nH]c2cc1C
Show InChI InChI=1S/C9H10N2/c1-6-3-8-9(4-7(6)2)11-5-10-8/h3-5H,1-2H3,(H,10,11)
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KEGG

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CHEMBL
MCE
KEGG
MMDB
PC cid
PC sid
PDB
UniChem

Patents


Similars

PubMed
n/an/a 9.70E+4n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of Aryl hydrocarbon hydroxylase in phenobarbitone-treated rats


J Med Chem 25: 622-6 (1982)


BindingDB Entry DOI: 10.7270/Q2474C1S
More data for this
Ligand-Target Pair
Cytochrome P450 1A1


(Rattus norvegicus)
BDBM50208872
PNG
(5,6-dimethyl-1H-benzimidazole | 5,6-dimethylbenzim...)
Show SMILES Cc1cc2nc[nH]c2cc1C
Show InChI InChI=1S/C9H10N2/c1-6-3-8-9(4-7(6)2)11-5-10-8/h3-5H,1-2H3,(H,10,11)
Reactome pathway
KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
Purchase

CHEMBL
MCE
KEGG
MMDB
PC cid
PC sid
PDB
UniChem

Patents


Similars

PubMed
n/an/a 9.77E+4n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of Aryl hydrocarbon hydroxylase in phenobarbitone-treated rats


J Med Chem 25: 622-6 (1982)


BindingDB Entry DOI: 10.7270/Q2474C1S
More data for this
Ligand-Target Pair