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BDBM50257118 CHEMBL475051::N1-hydroxy-N4-(3-(4-(pyridin-3-yl)thiazol-2-ylamino)phenyl)terephthalamide

SMILES: ONC(=O)c1ccc(cc1)C(=O)Nc1cccc(Nc2ncc(s2)-c2cccnc2)c1

InChI Key: InChIKey=CJXZQDNBKDLDLD-UHFFFAOYSA-N

Data: 5 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 5 hits for monomerid = 50257118   
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
Tyrosine-protein kinase ABL1


(Homo sapiens (Human))
BDBM50257118
PNG
(CHEMBL475051 | N1-hydroxy-N4-(3-(4-(pyridin-3-yl)t...)
Show SMILES ONC(=O)c1ccc(cc1)C(=O)Nc1cccc(Nc2ncc(s2)-c2cccnc2)c1
Show InChI InChI=1S/C22H17N5O3S/c28-20(14-6-8-15(9-7-14)21(29)27-30)25-17-4-1-5-18(11-17)26-22-24-13-19(31-22)16-3-2-10-23-12-16/h1-13,30H,(H,24,26)(H,25,28)(H,27,29)
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Article
PubMed
n/an/a 1.70E+4n/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
Cereblon/Histone deacetylase 1


(Homo sapiens (Human))
BDBM50257118
PNG
(CHEMBL475051 | N1-hydroxy-N4-(3-(4-(pyridin-3-yl)t...)
Show SMILES ONC(=O)c1ccc(cc1)C(=O)Nc1cccc(Nc2ncc(s2)-c2cccnc2)c1
Show InChI InChI=1S/C22H17N5O3S/c28-20(14-6-8-15(9-7-14)21(29)27-30)25-17-4-1-5-18(11-17)26-22-24-13-19(31-22)16-3-2-10-23-12-16/h1-13,30H,(H,24,26)(H,25,28)(H,27,29)
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Article
PubMed
n/an/a 210n/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
Cereblon/Histone deacetylase 6


(Homo sapiens (Human))
BDBM50257118
PNG
(CHEMBL475051 | N1-hydroxy-N4-(3-(4-(pyridin-3-yl)t...)
Show SMILES ONC(=O)c1ccc(cc1)C(=O)Nc1cccc(Nc2ncc(s2)-c2cccnc2)c1
Show InChI InChI=1S/C22H17N5O3S/c28-20(14-6-8-15(9-7-14)21(29)27-30)25-17-4-1-5-18(11-17)26-22-24-13-19(31-22)16-3-2-10-23-12-16/h1-13,30H,(H,24,26)(H,25,28)(H,27,29)
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Article
PubMed
n/an/a 91n/an/an/an/an/an/a



University of Regensburg

Curated by ChEMBL


Assay Description
Inhibition of human recombinant HDAC6 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
Vascular endothelial growth factor receptor 2


(Homo sapiens (Human))
BDBM50257118
PNG
(CHEMBL475051 | N1-hydroxy-N4-(3-(4-(pyridin-3-yl)t...)
Show SMILES ONC(=O)c1ccc(cc1)C(=O)Nc1cccc(Nc2ncc(s2)-c2cccnc2)c1
Show InChI InChI=1S/C22H17N5O3S/c28-20(14-6-8-15(9-7-14)21(29)27-30)25-17-4-1-5-18(11-17)26-22-24-13-19(31-22)16-3-2-10-23-12-16/h1-13,30H,(H,24,26)(H,25,28)(H,27,29)
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PubMed
n/an/a 4.30E+4n/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))
BDBM50257118
PNG
(CHEMBL475051 | N1-hydroxy-N4-(3-(4-(pyridin-3-yl)t...)
Show SMILES ONC(=O)c1ccc(cc1)C(=O)Nc1cccc(Nc2ncc(s2)-c2cccnc2)c1
Show InChI InChI=1S/C22H17N5O3S/c28-20(14-6-8-15(9-7-14)21(29)27-30)25-17-4-1-5-18(11-17)26-22-24-13-19(31-22)16-3-2-10-23-12-16/h1-13,30H,(H,24,26)(H,25,28)(H,27,29)
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Article
PubMed
n/an/a 4.00E+4n/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