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BDBM50245734 9-hydroxy-6-(3-morpholinopropyl)-4-phenylpyrrolo[3,4-c]carbazole-1,3(2H,6H)-dione::CHEMBL510668

SMILES: Oc1ccc2n(CCCN3CCOCC3)c3cc(c4C(=O)NC(=O)c4c3c2c1)-c1ccccc1

InChI Key: InChIKey=BVFLFSVYYYECQF-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 = 50245734   
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))
BDBM50245734
PNG
(9-hydroxy-6-(3-morpholinopropyl)-4-phenylpyrrolo[3...)
Show SMILES Oc1ccc2n(CCCN3CCOCC3)c3cc(c4C(=O)NC(=O)c4c3c2c1)-c1ccccc1
Show InChI InChI=1S/C27H25N3O4/c31-18-7-8-21-20(15-18)23-22(30(21)10-4-9-29-11-13-34-14-12-29)16-19(17-5-2-1-3-6-17)24-25(23)27(33)28-26(24)32/h1-3,5-8,15-16,31H,4,9-14H2,(H,28,32,33)
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PC cid
PC sid
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Article
PubMed
n/an/a 380n/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))
BDBM50245734
PNG
(9-hydroxy-6-(3-morpholinopropyl)-4-phenylpyrrolo[3...)
Show SMILES Oc1ccc2n(CCCN3CCOCC3)c3cc(c4C(=O)NC(=O)c4c3c2c1)-c1ccccc1
Show InChI InChI=1S/C27H25N3O4/c31-18-7-8-21-20(15-18)23-22(30(21)10-4-9-29-11-13-34-14-12-29)16-19(17-5-2-1-3-6-17)24-25(23)27(33)28-26(24)32/h1-3,5-8,15-16,31H,4,9-14H2,(H,28,32,33)
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PC sid
UniChem

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Article
PubMed
n/an/a 290n/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))
BDBM50245734
PNG
(9-hydroxy-6-(3-morpholinopropyl)-4-phenylpyrrolo[3...)
Show SMILES Oc1ccc2n(CCCN3CCOCC3)c3cc(c4C(=O)NC(=O)c4c3c2c1)-c1ccccc1
Show InChI InChI=1S/C27H25N3O4/c31-18-7-8-21-20(15-18)23-22(30(21)10-4-9-29-11-13-34-14-12-29)16-19(17-5-2-1-3-6-17)24-25(23)27(33)28-26(24)32/h1-3,5-8,15-16,31H,4,9-14H2,(H,28,32,33)
PDB
MMDB

KEGG

UniProtKB/SwissProt

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

Similars

Article
PubMed
n/an/a 4.60E+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