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BDBM50192350 9-hydroxy-4,5-diphenylpyrrolo[3,4-c]carbazole-1,3(2H,6H)-dione::CHEMBL385047

SMILES: Oc1ccc2[nH]c3c(-c4ccccc4)c(c4C(=O)NC(=O)c4c3c2c1)-c1ccccc1

InChI Key: InChIKey=DQBYFQXXFBDIBM-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 = 50192350   
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))
BDBM50192350
PNG
(9-hydroxy-4,5-diphenylpyrrolo[3,4-c]carbazole-1,3(...)
Show SMILES Oc1ccc2[nH]c3c(-c4ccccc4)c(c4C(=O)NC(=O)c4c3c2c1)-c1ccccc1
Show InChI InChI=1S/C26H16N2O3/c29-16-11-12-18-17(13-16)21-23-22(25(30)28-26(23)31)19(14-7-3-1-4-8-14)20(24(21)27-18)15-9-5-2-6-10-15/h1-13,27,29H,(H,28,30,31)
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PC cid
PC sid
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Similars

Article
PubMed
n/an/a 370n/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))
BDBM50192350
PNG
(9-hydroxy-4,5-diphenylpyrrolo[3,4-c]carbazole-1,3(...)
Show SMILES Oc1ccc2[nH]c3c(-c4ccccc4)c(c4C(=O)NC(=O)c4c3c2c1)-c1ccccc1
Show InChI InChI=1S/C26H16N2O3/c29-16-11-12-18-17(13-16)21-23-22(25(30)28-26(23)31)19(14-7-3-1-4-8-14)20(24(21)27-18)15-9-5-2-6-10-15/h1-13,27,29H,(H,28,30,31)
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Article
PubMed
n/an/a 2.34E+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))
BDBM50192350
PNG
(9-hydroxy-4,5-diphenylpyrrolo[3,4-c]carbazole-1,3(...)
Show SMILES Oc1ccc2[nH]c3c(-c4ccccc4)c(c4C(=O)NC(=O)c4c3c2c1)-c1ccccc1
Show InChI InChI=1S/C26H16N2O3/c29-16-11-12-18-17(13-16)21-23-22(25(30)28-26(23)31)19(14-7-3-1-4-8-14)20(24(21)27-18)15-9-5-2-6-10-15/h1-13,27,29H,(H,28,30,31)
PDB
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KEGG

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PC cid
PC sid
UniChem

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Article
PubMed
n/an/a 2.30E+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