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BDBM46052 1-(3,4-dihydroxyphenyl)-2-(5,6-dimethyl-1-benzimidazolyl)ethanone;hydrochloride::1-(3,4-dihydroxyphenyl)-2-(5,6-dimethylbenzimidazol-1-yl)ethanone;hydrochloride::1-[3,4-bis(oxidanyl)phenyl]-2-(5,6-dimethylbenzimidazol-1-yl)ethanone;hydrochloride::CHEMBL602242::MLS-0315851.0001::cid_25067489

SMILES: Cc1cc2ncn(CC(=O)c3ccc(O)c(O)c3)c2cc1C

InChI Key: InChIKey=FYCXFOMMDOYMPH-UHFFFAOYSA-N

Data: 4 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 4 hits for monomerid = 46052   
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
Alkaline phosphatase, tissue-nonspecific isozyme


(Homo sapiens (Human))
BDBM46052
PNG
(1-(3,4-dihydroxyphenyl)-2-(5,6-dimethyl-1-benzimid...)
Show SMILES Cc1cc2ncn(CC(=O)c3ccc(O)c(O)c3)c2cc1C
Show InChI InChI=1S/C17H16N2O3/c1-10-5-13-14(6-11(10)2)19(9-18-13)8-17(22)12-3-4-15(20)16(21)7-12/h3-7,9,20-21H,8H2,1-2H3
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/a>1.00E+5n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Sanford-Burnham Center for Chemical Genomics (SBCCG) Sanford-Burnham Medical Research Institute (SBMRI, San Diego, CA) NIH Molecular Libraries Screen...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2CR5RRG
More data for this
Ligand-Target Pair
Alkaline phosphatase, tissue-nonspecific isozyme


(Homo sapiens (Human))
BDBM46052
PNG
(1-(3,4-dihydroxyphenyl)-2-(5,6-dimethyl-1-benzimid...)
Show SMILES Cc1cc2ncn(CC(=O)c3ccc(O)c(O)c3)c2cc1C
Show InChI InChI=1S/C17H16N2O3/c1-10-5-13-14(6-11(10)2)19(9-18-13)8-17(22)12-3-4-15(20)16(21)7-12/h3-7,9,20-21H,8H2,1-2H3
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a>1.00E+5n/an/an/an/an/an/a



Human BioMolecular Research Institute

Curated by ChEMBL


Assay Description
Inhibition of TNAP by analogous luminescence assay


Bioorg Med Chem 18: 573-9 (2010)


Article DOI: 10.1016/j.bmc.2009.12.012
BindingDB Entry DOI: 10.7270/Q24T6JHR
More data for this
Ligand-Target Pair
Phospholipase A-2-activating protein


(Homo sapiens (Human))
BDBM46052
PNG
(1-(3,4-dihydroxyphenyl)-2-(5,6-dimethyl-1-benzimid...)
Show SMILES Cc1cc2ncn(CC(=O)c3ccc(O)c(O)c3)c2cc1C
Show InChI InChI=1S/C17H16N2O3/c1-10-5-13-14(6-11(10)2)19(9-18-13)8-17(22)12-3-4-15(20)16(21)7-12/h3-7,9,20-21H,8H2,1-2H3
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 5.80E+3n/an/an/an/an/an/a



Human BioMolecular Research Institute

Curated by ChEMBL


Assay Description
Inhibition of PLAP by analogous luminescence assay


Bioorg Med Chem 18: 573-9 (2010)


Article DOI: 10.1016/j.bmc.2009.12.012
BindingDB Entry DOI: 10.7270/Q24T6JHR
More data for this
Ligand-Target Pair
Alkaline phosphatase placental-like


(Homo sapiens (Human))
BDBM46052
PNG
(1-(3,4-dihydroxyphenyl)-2-(5,6-dimethyl-1-benzimid...)
Show SMILES Cc1cc2ncn(CC(=O)c3ccc(O)c(O)c3)c2cc1C
Show InChI InChI=1S/C17H16N2O3/c1-10-5-13-14(6-11(10)2)19(9-18-13)8-17(22)12-3-4-15(20)16(21)7-12/h3-7,9,20-21H,8H2,1-2H3
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/a 5.83E+3n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2009)


BindingDB Entry DOI: 10.7270/Q29S1PG8
More data for this
Ligand-Target Pair