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BDBM50192372 4-(2-chlorophenyl)-9-hydroxy-1H-[1]benzofuro[3,2-e]isoindole-1,3(2H)-dione::4-(2-chlorophenyl)-9-hydroxy-1H-benzofuro[3,2-e]isoindole-1,3(2H)-dione::CHEMBL386398

SMILES: Oc1ccc2oc3cc(c4C(=O)NC(=O)c4c3c2c1)-c1ccccc1Cl

InChI Key: InChIKey=KGAPFKLOTLAAMY-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 = 50192372   
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))
BDBM50192372
PNG
(4-(2-chlorophenyl)-9-hydroxy-1H-[1]benzofuro[3,2-e...)
Show SMILES Oc1ccc2oc3cc(c4C(=O)NC(=O)c4c3c2c1)-c1ccccc1Cl
Show InChI InChI=1S/C20H10ClNO4/c21-13-4-2-1-3-10(13)11-8-15-16(18-17(11)19(24)22-20(18)25)12-7-9(23)5-6-14(12)26-15/h1-8,23H,(H,22,24,25)
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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))
BDBM50192372
PNG
(4-(2-chlorophenyl)-9-hydroxy-1H-[1]benzofuro[3,2-e...)
Show SMILES Oc1ccc2oc3cc(c4C(=O)NC(=O)c4c3c2c1)-c1ccccc1Cl
Show InChI InChI=1S/C20H10ClNO4/c21-13-4-2-1-3-10(13)11-8-15-16(18-17(11)19(24)22-20(18)25)12-7-9(23)5-6-14(12)26-15/h1-8,23H,(H,22,24,25)
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Article
PubMed
n/an/a 33n/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))
BDBM50192372
PNG
(4-(2-chlorophenyl)-9-hydroxy-1H-[1]benzofuro[3,2-e...)
Show SMILES Oc1ccc2oc3cc(c4C(=O)NC(=O)c4c3c2c1)-c1ccccc1Cl
Show InChI InChI=1S/C20H10ClNO4/c21-13-4-2-1-3-10(13)11-8-15-16(18-17(11)19(24)22-20(18)25)12-7-9(23)5-6-14(12)26-15/h1-8,23H,(H,22,24,25)
PDB
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PC sid
UniChem

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Article
PubMed
n/an/a 33n/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