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Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Proto-oncogene tyrosine-protein kinase Src' and Ligand = 'BDBM50137585'   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/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))
BDBM50137585
PNG
(5-Ethanesulfonyl-3-[1-(3-morpholin-4-ylmethyl-4,5,...)
Show SMILES CCS(=O)(=O)c1ccc2NC(=O)\C(=C/c3[nH]c4CCCCc4c3CN3CCOCC3)c2c1
Show InChI InChI=1S/C24H29N3O4S/c1-2-32(29,30)16-7-8-22-18(13-16)19(24(28)26-22)14-23-20(15-27-9-11-31-12-10-27)17-5-3-4-6-21(17)25-23/h7-8,13-14,25H,2-6,9-12,15H2,1H3,(H,26,28)/b19-14-
PDB
MMDB

KEGG

UniProtKB/SwissProt

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

Similars

PubMed
n/an/a 70n/an/an/an/an/an/a



SUGEN, Inc.

Curated by ChEMBL


Assay Description
Inhibitory activity against Src protein tryrosine kinase


Bioorg Med Chem Lett 14: 187-90 (2003)


BindingDB Entry DOI: 10.7270/Q2HM57VG
More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase Src


(Homo sapiens (Human))
BDBM50137585
PNG
(5-Ethanesulfonyl-3-[1-(3-morpholin-4-ylmethyl-4,5,...)
Show SMILES CCS(=O)(=O)c1ccc2NC(=O)\C(=C/c3[nH]c4CCCCc4c3CN3CCOCC3)c2c1
Show InChI InChI=1S/C24H29N3O4S/c1-2-32(29,30)16-7-8-22-18(13-16)19(24(28)26-22)14-23-20(15-27-9-11-31-12-10-27)17-5-3-4-6-21(17)25-23/h7-8,13-14,25H,2-6,9-12,15H2,1H3,(H,26,28)/b19-14-
PDB
MMDB

KEGG

UniProtKB/SwissProt

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

Similars

PubMed
n/an/a 5.00E+3n/an/an/an/an/an/a



SUGEN, Inc.

Curated by ChEMBL


Assay Description
Inhibitory activity against Src protein tryrosine kinase


Bioorg Med Chem Lett 14: 187-90 (2003)


BindingDB Entry DOI: 10.7270/Q2HM57VG
More data for this
Ligand-Target Pair