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BDBM50192386 4-(3-acetylphenyl)-9-hydroxypyrrolo[3,4-c]carbazole-1,3(2H,6H)-dione::CHEMBL379322

SMILES: CC(=O)c1cccc(c1)-c1cc2[nH]c3ccc(O)cc3c2c2C(=O)NC(=O)c12

InChI Key: InChIKey=WUKKQKVUTCVNJH-UHFFFAOYSA-N

Data: 3 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 3 hits for monomerid = 50192386   
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))
BDBM50192386
PNG
(4-(3-acetylphenyl)-9-hydroxypyrrolo[3,4-c]carbazol...)
Show SMILES CC(=O)c1cccc(c1)-c1cc2[nH]c3ccc(O)cc3c2c2C(=O)NC(=O)c12
Show InChI InChI=1S/C22H14N2O4/c1-10(25)11-3-2-4-12(7-11)14-9-17-18(20-19(14)21(27)24-22(20)28)15-8-13(26)5-6-16(15)23-17/h2-9,23,26H,1H3,(H,24,27,28)
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PC cid
PC sid
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Article
PubMed
n/an/a>1.00E+4n/an/an/an/an/an/a



University of Auckland

Curated by ChEMBL


Assay Description
Inhibition at human Chk1 in presence of 4 uM ATP


J Med Chem 49: 4896-911 (2006)


Article DOI: 10.1021/jm0512591
BindingDB Entry DOI: 10.7270/Q23778BD
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase WEE1


(Homo sapiens (Human))
BDBM50192386
PNG
(4-(3-acetylphenyl)-9-hydroxypyrrolo[3,4-c]carbazol...)
Show SMILES CC(=O)c1cccc(c1)-c1cc2[nH]c3ccc(O)cc3c2c2C(=O)NC(=O)c12
Show InChI InChI=1S/C22H14N2O4/c1-10(25)11-3-2-4-12(7-11)14-9-17-18(20-19(14)21(27)24-22(20)28)15-8-13(26)5-6-16(15)23-17/h2-9,23,26H,1H3,(H,24,27,28)
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Article
PubMed
n/an/a 4.37E+3n/an/an/an/an/an/a



Chulalongkorn University

Curated by ChEMBL


Assay Description
Inhibition of human Wee1


Eur J Med Chem 44: 1383-95 (2009)


Article DOI: 10.1016/j.ejmech.2008.09.027
BindingDB Entry DOI: 10.7270/Q2X34XB6
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase WEE1


(Homo sapiens (Human))
BDBM50192386
PNG
(4-(3-acetylphenyl)-9-hydroxypyrrolo[3,4-c]carbazol...)
Show SMILES CC(=O)c1cccc(c1)-c1cc2[nH]c3ccc(O)cc3c2c2C(=O)NC(=O)c12
Show InChI InChI=1S/C22H14N2O4/c1-10(25)11-3-2-4-12(7-11)14-9-17-18(20-19(14)21(27)24-22(20)28)15-8-13(26)5-6-16(15)23-17/h2-9,23,26H,1H3,(H,24,27,28)
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Reactome pathway
KEGG

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PC cid
PC sid
UniChem

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Article
PubMed
n/an/a 4.30E+3n/an/an/an/an/an/a



University of Auckland

Curated by ChEMBL


Assay Description
Inhibition of human Wee1 in presence of 9.5 uM ATP


J Med Chem 49: 4896-911 (2006)


Article DOI: 10.1021/jm0512591
BindingDB Entry DOI: 10.7270/Q23778BD
More data for this
Ligand-Target Pair