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BDBM50245622 6-(2-(1H-imidazol-1-yl)ethyl)-9-hydroxy-4-phenylpyrrolo[3,4-c]carbazole-1,3(2H,6H)-dione::CHEMBL488899

SMILES: Oc1ccc2n(CCn3ccnc3)c3cc(c4C(=O)NC(=O)c4c3c2c1)-c1ccccc1

InChI Key: InChIKey=ARBSTLGRZNKZRL-UHFFFAOYSA-N

Data: 3 IC50

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   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 50245622   
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
Serine/threonine-protein kinase Chk1


(Homo sapiens (Human))
BDBM50245622
PNG
(6-(2-(1H-imidazol-1-yl)ethyl)-9-hydroxy-4-phenylpy...)
Show SMILES Oc1ccc2n(CCn3ccnc3)c3cc(c4C(=O)NC(=O)c4c3c2c1)-c1ccccc1
Show InChI InChI=1S/C25H18N4O3/c30-16-6-7-19-18(12-16)21-20(29(19)11-10-28-9-8-26-14-28)13-17(15-4-2-1-3-5-15)22-23(21)25(32)27-24(22)31/h1-9,12-14,30H,10-11H2,(H,27,31,32)
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PC cid
PC sid
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Similars

Article
PubMed
n/an/a 250n/an/an/an/an/an/a



University of Auckland

Curated by ChEMBL


Assay Description
Inhibition of Chk1 kinase assessed as GST-Cdc25 phosphorylation by Western blot determination


Eur J Med Chem 43: 1276-96 (2008)


Article DOI: 10.1016/j.ejmech.2007.07.016
BindingDB Entry DOI: 10.7270/Q26M36MC
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase WEE1


(Homo sapiens (Human))
BDBM50245622
PNG
(6-(2-(1H-imidazol-1-yl)ethyl)-9-hydroxy-4-phenylpy...)
Show SMILES Oc1ccc2n(CCn3ccnc3)c3cc(c4C(=O)NC(=O)c4c3c2c1)-c1ccccc1
Show InChI InChI=1S/C25H18N4O3/c30-16-6-7-19-18(12-16)21-20(29(19)11-10-28-9-8-26-14-28)13-17(15-4-2-1-3-5-15)22-23(21)25(32)27-24(22)31/h1-9,12-14,30H,10-11H2,(H,27,31,32)
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PC sid
UniChem

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Article
PubMed
n/an/a 230n/an/an/an/an/an/a



University of Auckland

Curated by ChEMBL


Assay Description
Inhibition of human Wee1 assessed as polyornithine-tyrosine copolymer phosphorylation


Eur J Med Chem 43: 1276-96 (2008)


Article DOI: 10.1016/j.ejmech.2007.07.016
BindingDB Entry DOI: 10.7270/Q26M36MC
More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase Src


(Homo sapiens (Human))
BDBM50245622
PNG
(6-(2-(1H-imidazol-1-yl)ethyl)-9-hydroxy-4-phenylpy...)
Show SMILES Oc1ccc2n(CCn3ccnc3)c3cc(c4C(=O)NC(=O)c4c3c2c1)-c1ccccc1
Show InChI InChI=1S/C25H18N4O3/c30-16-6-7-19-18(12-16)21-20(29(19)11-10-28-9-8-26-14-28)13-17(15-4-2-1-3-5-15)22-23(21)25(32)27-24(22)31/h1-9,12-14,30H,10-11H2,(H,27,31,32)
PDB
MMDB

KEGG

UniProtKB/SwissProt

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

Similars

Article
PubMed
n/an/a 2.70E+4n/an/an/an/an/an/a



University of Auckland

Curated by ChEMBL


Assay Description
Inhibition of c-Src


Eur J Med Chem 43: 1276-96 (2008)


Article DOI: 10.1016/j.ejmech.2007.07.016
BindingDB Entry DOI: 10.7270/Q26M36MC
More data for this
Ligand-Target Pair