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BDBM50293860 (S)-2-(3-Benzoylphenyl)-N-(3,4-dihydroxyphenethyl)propanamide::CHEMBL560356

SMILES: C[C@H](C(=O)NCCc1ccc(O)c(O)c1)c1cccc(Oc2ccccc2)c1

InChI Key: InChIKey=CECXAXJMMNBDRN-INIZCTEOSA-N

Data: 2 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 2 hits for monomerid = 50293860   
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
Zinc finger protein GLI2


(Homo sapiens (Human))
BDBM50293860
PNG
((S)-2-(3-Benzoylphenyl)-N-(3,4-dihydroxyphenethyl)...)
Show SMILES C[C@H](C(=O)NCCc1ccc(O)c(O)c1)c1cccc(Oc2ccccc2)c1 |r|
Show InChI InChI=1S/C23H23NO4/c1-16(23(27)24-13-12-17-10-11-21(25)22(26)14-17)18-6-5-9-20(15-18)28-19-7-3-2-4-8-19/h2-11,14-16,25-26H,12-13H2,1H3,(H,24,27)/t16-/m0/s1
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

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

Similars

Article
PubMed
n/an/a 2.94E+4n/an/an/an/an/an/a



St Jude Children's Research Hospital

Curated by ChEMBL


Assay Description
Inhibition of exogenously transfected human Gli2 deltaN-mediated transcriptional activity in mouse C3H10T1/2 cells after 24 hrs by luciferase reporte...


J Med Chem 52: 4277-87 (2009)


Article DOI: 10.1021/jm900106f
BindingDB Entry DOI: 10.7270/Q2QJ7H9J
More data for this
Ligand-Target Pair
Zinc finger protein GLI1


(Homo sapiens (Human))
BDBM50293860
PNG
((S)-2-(3-Benzoylphenyl)-N-(3,4-dihydroxyphenethyl)...)
Show SMILES C[C@H](C(=O)NCCc1ccc(O)c(O)c1)c1cccc(Oc2ccccc2)c1 |r|
Show InChI InChI=1S/C23H23NO4/c1-16(23(27)24-13-12-17-10-11-21(25)22(26)14-17)18-6-5-9-20(15-18)28-19-7-3-2-4-8-19/h2-11,14-16,25-26H,12-13H2,1H3,(H,24,27)/t16-/m0/s1
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

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

Similars

Article
PubMed
n/an/a 1.14E+4n/an/an/an/an/an/a



St Jude Children's Research Hospital

Curated by ChEMBL


Assay Description
Inhibition of exogenously transfected human Gli1-mediated transcriptional activity in mouse C3H10T1/2 cells after 24 hrs by luciferase reporter gene ...


J Med Chem 52: 4277-87 (2009)


Article DOI: 10.1021/jm900106f
BindingDB Entry DOI: 10.7270/Q2QJ7H9J
More data for this
Ligand-Target Pair