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BDBM50040913 1,4-Diphenyl-1,2,3,4-tetrahydro-pyrrolo[3,4-g]quinoxaline-6,8-dione::CHEMBL266255

SMILES: O=C1NC(=O)c2cc3N(CCN(c4ccccc4)c3cc12)c1ccccc1

InChI Key: InChIKey=DNRPTTQOSZQOGJ-UHFFFAOYSA-N

Data: 4 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 4 hits for monomerid = 50040913   
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
Proto-oncogene tyrosine-protein kinase Src


(Homo sapiens (Human))
BDBM50040913
PNG
(1,4-Diphenyl-1,2,3,4-tetrahydro-pyrrolo[3,4-g]quin...)
Show SMILES O=C1NC(=O)c2cc3N(CCN(c4ccccc4)c3cc12)c1ccccc1
Show InChI InChI=1S/C22H17N3O2/c26-21-17-13-19-20(14-18(17)22(27)23-21)25(16-9-5-2-6-10-16)12-11-24(19)15-7-3-1-4-8-15/h1-10,13-14H,11-12H2,(H,23,26,27)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
PubMed
n/an/a>5.00E+4n/an/an/an/an/an/a



Ciba-Geigy Limited

Curated by ChEMBL


Assay Description
Inhibitory activity against c-src tyrosine kinase


J Med Chem 37: 1015-27 (1994)


BindingDB Entry DOI: 10.7270/Q2M32TTP
More data for this
Ligand-Target Pair
Cyclic AMP-dependent protein kinase (PKA)


(Oryctolagus cuniculus (Rabbit))
BDBM50040913
PNG
(1,4-Diphenyl-1,2,3,4-tetrahydro-pyrrolo[3,4-g]quin...)
Show SMILES O=C1NC(=O)c2cc3N(CCN(c4ccccc4)c3cc12)c1ccccc1
Show InChI InChI=1S/C22H17N3O2/c26-21-17-13-19-20(14-18(17)22(27)23-21)25(16-9-5-2-6-10-16)12-11-24(19)15-7-3-1-4-8-15/h1-10,13-14H,11-12H2,(H,23,26,27)
PDB
MMDB

KEGG

UniProtKB/TrEMBL

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
PubMed
n/an/a>5.00E+5n/an/an/an/an/an/a



Ciba-Geigy Limited

Curated by ChEMBL


Assay Description
Inhibitory activity was determined against protein kinase A (PKA) of rabbit


J Med Chem 37: 1015-27 (1994)


BindingDB Entry DOI: 10.7270/Q2M32TTP
More data for this
Ligand-Target Pair
Epidermal growth factor receptor


(Homo sapiens (Human))
BDBM50040913
PNG
(1,4-Diphenyl-1,2,3,4-tetrahydro-pyrrolo[3,4-g]quin...)
Show SMILES O=C1NC(=O)c2cc3N(CCN(c4ccccc4)c3cc12)c1ccccc1
Show InChI InChI=1S/C22H17N3O2/c26-21-17-13-19-20(14-18(17)22(27)23-21)25(16-9-5-2-6-10-16)12-11-24(19)15-7-3-1-4-8-15/h1-10,13-14H,11-12H2,(H,23,26,27)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
PubMed
n/an/a>1.00E+5n/an/an/an/an/an/a



Ciba-Geigy Limited

Curated by ChEMBL


Assay Description
Inhibitory activity against recombinant tyrosine kinase EGF-R (EGF-R ICD)


J Med Chem 37: 1015-27 (1994)


BindingDB Entry DOI: 10.7270/Q2M32TTP
More data for this
Ligand-Target Pair
Tyrosine-protein kinase ABL


(Homo sapiens (Human))
BDBM50040913
PNG
(1,4-Diphenyl-1,2,3,4-tetrahydro-pyrrolo[3,4-g]quin...)
Show SMILES O=C1NC(=O)c2cc3N(CCN(c4ccccc4)c3cc12)c1ccccc1
Show InChI InChI=1S/C22H17N3O2/c26-21-17-13-19-20(14-18(17)22(27)23-21)25(16-9-5-2-6-10-16)12-11-24(19)15-7-3-1-4-8-15/h1-10,13-14H,11-12H2,(H,23,26,27)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
PubMed
n/an/a>5.00E+4n/an/an/an/an/an/a



Ciba-Geigy Limited

Curated by ChEMBL


Assay Description
Inhibitory activity against v-abl tyrosine kinase


J Med Chem 37: 1015-27 (1994)


BindingDB Entry DOI: 10.7270/Q2M32TTP
More data for this
Ligand-Target Pair