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Compile Data Set for Download or QSAR

Found 8 hits of ic50 for UniProtKB: P12931   
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 [S345C]


(Homo sapiens (Human))
BDBM259848
PNG
(US9505766, 52)
Show SMILES CN(C)C(=O)C(=C\c1cccc(c1)-n1cc(-c2ccc(Cl)cc2)c2c(N)ncnc12)\C#N
Show InChI InChI=1S/C24H19ClN6O/c1-30(2)24(32)17(12-26)10-15-4-3-5-19(11-15)31-13-20(16-6-8-18(25)9-7-16)21-22(27)28-14-29-23(21)31/h3-11,13-14H,1-2H3,(H2,27,28,29)/b17-10+
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 80n/an/an/an/a7.425



THE REGENTS OF THE UNIVERSITY OF CALIFORNIA

US Patent


Assay Description
Wild-type and S345C mutant cSrc kinase domains were expressed and purified as described (Blair et al., Nat. Chem. Biol., 2007). The purified cSrc kin...


US Patent US9505766 (2016)


BindingDB Entry DOI: 10.7270/Q2639NPR
More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase Src [S345C]


(Homo sapiens (Human))
BDBM259854
PNG
(US9505766, 58)
Show SMILES Nc1ncnc2n(cc(-c3ccc(Oc4ccccc4)cc3)c12)-c1cccc(\C=C(/C#N)C(=O)N2CC(O)C2)c1
Show InChI InChI=1S/C31H24N6O3/c32-15-22(31(39)36-16-24(38)17-36)13-20-5-4-6-23(14-20)37-18-27(28-29(33)34-19-35-30(28)37)21-9-11-26(12-10-21)40-25-7-2-1-3-8-25/h1-14,18-19,24,38H,16-17H2,(H2,33,34,35)/b22-13+
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 290n/an/an/an/a7.425



THE REGENTS OF THE UNIVERSITY OF CALIFORNIA

US Patent


Assay Description
Wild-type and S345C mutant cSrc kinase domains were expressed and purified as described (Blair et al., Nat. Chem. Biol., 2007). The purified cSrc kin...


US Patent US9505766 (2016)


BindingDB Entry DOI: 10.7270/Q2639NPR
More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase Src [S345C]


(Homo sapiens (Human))
BDBM259851
PNG
(US9505766, 55)
Show SMILES Nc1ncnc2n(cc(-c3ccc(Cl)cc3)c12)-c1cccc(\C=C(/C#N)C(=O)N2CC(O)C2)c1
Show InChI InChI=1S/C25H19ClN6O2/c26-18-6-4-16(5-7-18)21-13-32(24-22(21)23(28)29-14-30-24)19-3-1-2-15(9-19)8-17(10-27)25(34)31-11-20(33)12-31/h1-9,13-14,20,33H,11-12H2,(H2,28,29,30)/b17-8+
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 490n/an/an/an/a7.425



THE REGENTS OF THE UNIVERSITY OF CALIFORNIA

US Patent


Assay Description
Wild-type and S345C mutant cSrc kinase domains were expressed and purified as described (Blair et al., Nat. Chem. Biol., 2007). The purified cSrc kin...


US Patent US9505766 (2016)


BindingDB Entry DOI: 10.7270/Q2639NPR
More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase Src [S345C]


(Homo sapiens (Human))
BDBM259847
PNG
(US9505766, 51)
Show SMILES NC(=O)C(=C\c1cccc(c1)-n1cc(-c2ccc(Cl)cc2)c2c(N)ncnc12)\C#N
Show InChI InChI=1S/C22H15ClN6O/c23-16-6-4-14(5-7-16)18-11-29(22-19(18)20(25)27-12-28-22)17-3-1-2-13(9-17)8-15(10-24)21(26)30/h1-9,11-12H,(H2,26,30)(H2,25,27,28)/b15-8+
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 520n/an/an/an/a7.425



THE REGENTS OF THE UNIVERSITY OF CALIFORNIA

US Patent


Assay Description
Wild-type and S345C mutant cSrc kinase domains were expressed and purified as described (Blair et al., Nat. Chem. Biol., 2007). The purified cSrc kin...


US Patent US9505766 (2016)


BindingDB Entry DOI: 10.7270/Q2639NPR
More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase Src [S345C]


(Homo sapiens (Human))
BDBM259852
PNG
(US9505766, 56)
Show SMILES CN1CCN(CC1)C(=O)C(=C\c1cccc(c1)-n1cc(-c2ccc(Cl)cc2)c2c(N)ncnc12)\C#N
Show InChI InChI=1S/C27H24ClN7O/c1-33-9-11-34(12-10-33)27(36)20(15-29)13-18-3-2-4-22(14-18)35-16-23(19-5-7-21(28)8-6-19)24-25(30)31-17-32-26(24)35/h2-8,13-14,16-17H,9-12H2,1H3,(H2,30,31,32)/b20-13+
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 1.20E+3n/an/an/an/a7.425



THE REGENTS OF THE UNIVERSITY OF CALIFORNIA

US Patent


Assay Description
Wild-type and S345C mutant cSrc kinase domains were expressed and purified as described (Blair et al., Nat. Chem. Biol., 2007). The purified cSrc kin...


US Patent US9505766 (2016)


BindingDB Entry DOI: 10.7270/Q2639NPR
More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase Src [S345C]


(Homo sapiens (Human))
BDBM259853
PNG
(US9505766, 57)
Show SMILES CN1CCN(CC1)C(=O)C(=C\c1cccc(c1)-n1cc(-c2ccc(Oc3ccccc3)cc2)c2c(N)ncnc12)\C#N
Show InChI InChI=1S/C33H29N7O2/c1-38-14-16-39(17-15-38)33(41)25(20-34)18-23-6-5-7-26(19-23)40-21-29(30-31(35)36-22-37-32(30)40)24-10-12-28(13-11-24)42-27-8-3-2-4-9-27/h2-13,18-19,21-22H,14-17H2,1H3,(H2,35,36,37)/b25-18+
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 2.10E+3n/an/an/an/a7.425



THE REGENTS OF THE UNIVERSITY OF CALIFORNIA

US Patent


Assay Description
Wild-type and S345C mutant cSrc kinase domains were expressed and purified as described (Blair et al., Nat. Chem. Biol., 2007). The purified cSrc kin...


US Patent US9505766 (2016)


BindingDB Entry DOI: 10.7270/Q2639NPR
More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase Src [S345C]


(Homo sapiens (Human))
BDBM259849
PNG
(US9505766, 53)
Show SMILES Nc1ncnc2n(cc(-c3ccc(Cl)cc3)c12)-c1cccc(\C=C(/C#N)C(=O)N2CCC2)c1
Show InChI InChI=1S/C25H19ClN6O/c26-19-7-5-17(6-8-19)21-14-32(24-22(21)23(28)29-15-30-24)20-4-1-3-16(12-20)11-18(13-27)25(33)31-9-2-10-31/h1,3-8,11-12,14-15H,2,9-10H2,(H2,28,29,30)/b18-11+
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 2.50E+3n/an/an/an/a7.425



THE REGENTS OF THE UNIVERSITY OF CALIFORNIA

US Patent


Assay Description
Wild-type and S345C mutant cSrc kinase domains were expressed and purified as described (Blair et al., Nat. Chem. Biol., 2007). The purified cSrc kin...


US Patent US9505766 (2016)


BindingDB Entry DOI: 10.7270/Q2639NPR
More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase Src [S345C]


(Homo sapiens (Human))
BDBM259878
PNG
(US9505766, 83)
Show SMILES CC(C)(CO)NC(=O)C(=C\c1cccc(c1)-n1cc(-c2ccc(Oc3ccccc3)cc2)c2c(N)ncnc12)\C#N
Show InChI InChI=1S/C32H28N6O3/c1-32(2,19-39)37-31(40)23(17-33)15-21-7-6-8-24(16-21)38-18-27(28-29(34)35-20-36-30(28)38)22-11-13-26(14-12-22)41-25-9-4-3-5-10-25/h3-16,18,20,39H,19H2,1-2H3,(H,37,40)(H2,34,35,36)/b23-15+
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a>1.00E+4n/an/an/an/a7.425



THE REGENTS OF THE UNIVERSITY OF CALIFORNIA

US Patent


Assay Description
Wild-type and S345C mutant cSrc kinase domains were expressed and purified as described (Blair et al., Nat. Chem. Biol., 2007). The purified cSrc kin...


US Patent US9505766 (2016)


BindingDB Entry DOI: 10.7270/Q2639NPR
More data for this
Ligand-Target Pair