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SMILES: Nc1ccccc1NC(=O)c1ccc(cc1)C(=O)Nc1cccc(Nc2ncc(cn2)-c2cccnc2)c1

InChI Key: InChIKey=XNLVVTGACFLHMS-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 4 hits for monomerid = 50257031   
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
Histone deacetylase 1


(Homo sapiens (Human))
BDBM50257031
PNG
(CHEMBL473826 | N1-(2-aminophenyl)-N4-(3-(4-(pyridi...)
Show SMILES Nc1ccccc1NC(=O)c1ccc(cc1)C(=O)Nc1cccc(Nc2ncc(cn2)-c2cccnc2)c1
Show InChI InChI=1S/C29H23N7O2/c30-25-8-1-2-9-26(25)36-28(38)20-12-10-19(11-13-20)27(37)34-23-6-3-7-24(15-23)35-29-32-17-22(18-33-29)21-5-4-14-31-16-21/h1-18H,30H2,(H,34,37)(H,36,38)(H,32,33,35)
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Article
PubMed
n/an/a 760n/an/an/an/an/an/a



University of Regensburg

Curated by ChEMBL


Assay Description
Inhibition of human recombinant HDAC1 expressed in HEK293 cells


J Med Chem 52: 2265-79 (2009)


Article DOI: 10.1021/jm800988r
BindingDB Entry DOI: 10.7270/Q2NS0TSP
More data for this
Ligand-Target Pair
Tyrosine-protein kinase ABL1


(Homo sapiens (Human))
BDBM50257031
PNG
(CHEMBL473826 | N1-(2-aminophenyl)-N4-(3-(4-(pyridi...)
Show SMILES Nc1ccccc1NC(=O)c1ccc(cc1)C(=O)Nc1cccc(Nc2ncc(cn2)-c2cccnc2)c1
Show InChI InChI=1S/C29H23N7O2/c30-25-8-1-2-9-26(25)36-28(38)20-12-10-19(11-13-20)27(37)34-23-6-3-7-24(15-23)35-29-32-17-22(18-33-29)21-5-4-14-31-16-21/h1-18H,30H2,(H,34,37)(H,36,38)(H,32,33,35)
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Article
PubMed
n/an/a 7.80E+3n/an/an/an/an/an/a



University of Regensburg

Curated by ChEMBL


Assay Description
Inhibition of wild-type c-Abl (unknown origin) by liquid scintillation counting


J Med Chem 52: 2265-79 (2009)


Article DOI: 10.1021/jm800988r
BindingDB Entry DOI: 10.7270/Q2NS0TSP
More data for this
Ligand-Target Pair
Vascular endothelial growth factor receptor 2


(Homo sapiens (Human))
BDBM50257031
PNG
(CHEMBL473826 | N1-(2-aminophenyl)-N4-(3-(4-(pyridi...)
Show SMILES Nc1ccccc1NC(=O)c1ccc(cc1)C(=O)Nc1cccc(Nc2ncc(cn2)-c2cccnc2)c1
Show InChI InChI=1S/C29H23N7O2/c30-25-8-1-2-9-26(25)36-28(38)20-12-10-19(11-13-20)27(37)34-23-6-3-7-24(15-23)35-29-32-17-22(18-33-29)21-5-4-14-31-16-21/h1-18H,30H2,(H,34,37)(H,36,38)(H,32,33,35)
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PubMed
n/an/a 1.50E+3n/an/an/an/an/an/a



University of Regensburg

Curated by ChEMBL


Assay Description
Inhibition of VEGFR2 (unknown origin) by liquid scintillation counting


J Med Chem 52: 2265-79 (2009)


Article DOI: 10.1021/jm800988r
BindingDB Entry DOI: 10.7270/Q2NS0TSP
More data for this
Ligand-Target Pair
Platelet-derived growth factor receptor beta


(Homo sapiens (Human))
BDBM50257031
PNG
(CHEMBL473826 | N1-(2-aminophenyl)-N4-(3-(4-(pyridi...)
Show SMILES Nc1ccccc1NC(=O)c1ccc(cc1)C(=O)Nc1cccc(Nc2ncc(cn2)-c2cccnc2)c1
Show InChI InChI=1S/C29H23N7O2/c30-25-8-1-2-9-26(25)36-28(38)20-12-10-19(11-13-20)27(37)34-23-6-3-7-24(15-23)35-29-32-17-22(18-33-29)21-5-4-14-31-16-21/h1-18H,30H2,(H,34,37)(H,36,38)(H,32,33,35)
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Article
PubMed
n/an/a 1.10E+3n/an/an/an/an/an/a



University of Regensburg

Curated by ChEMBL


Assay Description
Inhibition of PDGFRbeta (unknown origin) by liquid scintillation counting


J Med Chem 52: 2265-79 (2009)


Article DOI: 10.1021/jm800988r
BindingDB Entry DOI: 10.7270/Q2NS0TSP
More data for this
Ligand-Target Pair