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BDBM50177402 1-(4-hydroxy-phenyl)-propan-1-one::1-(4-hydroxyphenyl)propan-1-one::4'-Hydroxypropiophenone::CHEMBL312311::Paroxypropione

SMILES: CCC(=O)c1ccc(O)cc1

InChI Key: InChIKey=RARSHUDCJQSEFJ-UHFFFAOYSA-N

Data: 3 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 50177402   
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
Gamma-amino-N-butyrate transaminase


(Homo sapiens (Human))
BDBM50177402
PNG
(1-(4-hydroxy-phenyl)-propan-1-one | 1-(4-hydroxyph...)
Show SMILES CCC(=O)c1ccc(O)cc1
Show InChI InChI=1S/C9H10O2/c1-2-9(11)7-3-5-8(10)6-4-7/h3-6,10H,2H2,1H3
PDB
MMDB

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CHEMBL
KEGG
PC cid
PC sid
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Article
PubMed
n/an/a 1.76E+5n/an/an/an/an/an/a



Huazhong University of Science and Technology

Curated by ChEMBL


Assay Description
Inhibitory activity against GABAT


Bioorg Med Chem Lett 16: 592-5 (2005)


Article DOI: 10.1016/j.bmcl.2005.10.040
BindingDB Entry DOI: 10.7270/Q29G5MCH
More data for this
Ligand-Target Pair
17-beta-hydroxysteroid dehydrogenase type 3


(Homo sapiens (Human))
BDBM50177402
PNG
(1-(4-hydroxy-phenyl)-propan-1-one | 1-(4-hydroxyph...)
Show SMILES CCC(=O)c1ccc(O)cc1
Show InChI InChI=1S/C9H10O2/c1-2-9(11)7-3-5-8(10)6-4-7/h3-6,10H,2H2,1H3
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KEGG

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CHEMBL
KEGG
PC cid
PC sid
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Article
PubMed
n/an/a 1.51E+5n/an/an/an/an/an/a



Kingston University

Curated by ChEMBL


Assay Description
Inhibition of 17beta-HSD3


Bioorg Med Chem Lett 16: 4519-22 (2006)


Article DOI: 10.1016/j.bmcl.2006.06.029
BindingDB Entry DOI: 10.7270/Q2D21X7Q
More data for this
Ligand-Target Pair
Succinate semialdehyde dehydrogenase


(Homo sapiens (Human))
BDBM50177402
PNG
(1-(4-hydroxy-phenyl)-propan-1-one | 1-(4-hydroxyph...)
Show SMILES CCC(=O)c1ccc(O)cc1
Show InChI InChI=1S/C9H10O2/c1-2-9(11)7-3-5-8(10)6-4-7/h3-6,10H,2H2,1H3
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
Purchase

CHEMBL
KEGG
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
n/an/a 2.93E+5n/an/an/an/an/an/a



Huazhong University of Science and Technology

Curated by ChEMBL


Assay Description
Inhibitory activity against SSADH


Bioorg Med Chem Lett 16: 592-5 (2005)


Article DOI: 10.1016/j.bmcl.2005.10.040
BindingDB Entry DOI: 10.7270/Q29G5MCH
More data for this
Ligand-Target Pair