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SMILES: Cc1ccccc1Cc1cc2c(Nc3cccc(Br)c3)nc(N)nc2n1C

InChI Key: InChIKey=QUYCCARCAMJDBA-UHFFFAOYSA-N

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 = 50326613   
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
Epidermal growth factor receptor


(Homo sapiens (Human))
BDBM50326613
PNG
(2-Amino-4-(m-bromoanilino)-6-(2-methylbenzyl)-7-me...)
Show SMILES Cc1ccccc1Cc1cc2c(Nc3cccc(Br)c3)nc(N)nc2n1C
Show InChI InChI=1S/C21H20BrN5/c1-13-6-3-4-7-14(13)10-17-12-18-19(24-16-9-5-8-15(22)11-16)25-21(23)26-20(18)27(17)2/h3-9,11-12H,10H2,1-2H3,(H3,23,24,25,26)
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KEGG

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PC cid
PC sid
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Similars

Article
PubMed
n/an/a 1.28E+4n/an/an/an/an/an/a



Duquesne University

Curated by ChEMBL


Assay Description
Inhibition of EGFR expressed in human A431 cells


Bioorg Med Chem 18: 5261-73 (2010)


Article DOI: 10.1016/j.bmc.2010.05.049
BindingDB Entry DOI: 10.7270/Q29Z95W6
More data for this
Ligand-Target Pair
Platelet-derived growth factor receptor beta


(Homo sapiens (Human))
BDBM50326613
PNG
(2-Amino-4-(m-bromoanilino)-6-(2-methylbenzyl)-7-me...)
Show SMILES Cc1ccccc1Cc1cc2c(Nc3cccc(Br)c3)nc(N)nc2n1C
Show InChI InChI=1S/C21H20BrN5/c1-13-6-3-4-7-14(13)10-17-12-18-19(24-16-9-5-8-15(22)11-16)25-21(23)26-20(18)27(17)2/h3-9,11-12H,10H2,1-2H3,(H3,23,24,25,26)
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PC sid
UniChem

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Article
PubMed
n/an/a>5.00E+5n/an/an/an/an/an/a



Duquesne University

Curated by ChEMBL


Assay Description
Inhibition of PDGFRbeta expressed in human A431 cells


Bioorg Med Chem 18: 5261-73 (2010)


Article DOI: 10.1016/j.bmc.2010.05.049
BindingDB Entry DOI: 10.7270/Q29Z95W6
More data for this
Ligand-Target Pair
Vascular endothelial growth factor receptor 2


(Homo sapiens (Human))
BDBM50326613
PNG
(2-Amino-4-(m-bromoanilino)-6-(2-methylbenzyl)-7-me...)
Show SMILES Cc1ccccc1Cc1cc2c(Nc3cccc(Br)c3)nc(N)nc2n1C
Show InChI InChI=1S/C21H20BrN5/c1-13-6-3-4-7-14(13)10-17-12-18-19(24-16-9-5-8-15(22)11-16)25-21(23)26-20(18)27(17)2/h3-9,11-12H,10H2,1-2H3,(H3,23,24,25,26)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

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

Similars

Article
PubMed
n/an/a 1.16E+5n/an/an/an/an/an/a



Duquesne University

Curated by ChEMBL


Assay Description
Inhibition of VEGFR2 expressed in human A431 cells


Bioorg Med Chem 18: 5261-73 (2010)


Article DOI: 10.1016/j.bmc.2010.05.049
BindingDB Entry DOI: 10.7270/Q29Z95W6
More data for this
Ligand-Target Pair