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Compile Data Set for Download or QSAR

Found 4 hits of affinity data for UniProtKB/TrEMBL: P14769   
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
N-acetyllactosaminide alpha-1,3-galactosyltransferase


(Bos taurus)
BDBM50389789
PNG
(CHEMBL1229737)
Show SMILES OC[C@H]1O[C@H](OP(O)(=O)OP(O)(=O)OC[C@H]2O[C@H]([C@H](O)[C@@H]2O)n2cc(-c3ccc(C=O)s3)c(=O)[nH]c2=O)[C@H](O)[C@@H](O)[C@H]1O |r|
Show InChI InChI=1S/C20H26N2O18P2S/c23-4-7-1-2-11(43-7)8-3-22(20(31)21-17(8)30)18-15(28)13(26)10(37-18)6-36-41(32,33)40-42(34,35)39-19-16(29)14(27)12(25)9(5-24)38-19/h1-4,9-10,12-16,18-19,24-29H,5-6H2,(H,32,33)(H,34,35)(H,21,30,31)/t9-,10-,12+,13-,14+,15-,16-,18-,19-/m1/s1
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
PDB
UniChem

Similars

Article
PubMed
9.80E+3n/an/an/an/an/an/an/an/a



University of East Anglia

Curated by ChEMBL


Assay Description
Inhibition of alpha-1,3-GalT in bovine after 15 mins by Dixon plot analysis


J Med Chem 55: 2015-24 (2012)


Article DOI: 10.1021/jm201154p
BindingDB Entry DOI: 10.7270/Q28W3FCH
More data for this
Ligand-Target Pair
N-acetyllactosaminide alpha-1,3-galactosyltransferase


(Bos taurus)
BDBM50389786
PNG
(CHEMBL2070378)
Show SMILES OC[C@H]1O[C@H](CCP(O)(=O)OP(O)(=O)OC[C@H]2O[C@H]([C@H](O)[C@@H]2O)n2cc(-c3ccc(C=O)s3)c(=O)[nH]c2=O)[C@H](O)[C@@H](O)[C@H]1O |r|
Show InChI InChI=1S/C22H30N2O17P2S/c25-6-9-1-2-14(44-9)10-5-24(22(33)23-20(10)32)21-19(31)17(29)13(40-21)8-38-43(36,37)41-42(34,35)4-3-11-15(27)18(30)16(28)12(7-26)39-11/h1-2,5-6,11-13,15-19,21,26-31H,3-4,7-8H2,(H,34,35)(H,36,37)(H,23,32,33)/t11-,12-,13-,15+,16+,17-,18-,19-,21-/m1/s1
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
1.80E+4n/an/an/an/an/an/an/an/a



University of East Anglia

Curated by ChEMBL


Assay Description
Inhibition of alpha-1,3-GalT in bovine after 15 mins by Dixon plot analysis


J Med Chem 55: 2015-24 (2012)


Article DOI: 10.1021/jm201154p
BindingDB Entry DOI: 10.7270/Q28W3FCH
More data for this
Ligand-Target Pair
N-acetyllactosaminide alpha-1,3-galactosyltransferase


(Bos taurus)
BDBM50389788
PNG
(CHEMBL2070375)
Show SMILES OC[C@H]1O[C@H](OP(O)(=O)OP(O)(=O)OC[C@H]2O[C@H]([C@H](O)[C@@H]2O)n2cc(-c3ccccc3)c(=O)[nH]c2=O)[C@H](O)[C@@H](O)[C@H]1O |r|
Show InChI InChI=1S/C21H28N2O17P2/c24-7-11-13(25)15(27)17(29)20(38-11)39-42(34,35)40-41(32,33)36-8-12-14(26)16(28)19(37-12)23-6-10(18(30)22-21(23)31)9-4-2-1-3-5-9/h1-6,11-17,19-20,24-29H,7-8H2,(H,32,33)(H,34,35)(H,22,30,31)/t11-,12-,13+,14-,15+,16-,17-,19-,20-/m1/s1
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
MMDB
PC cid
PC sid
PDB
UniChem

Similars

Article
PubMed
7.60E+4n/an/an/an/an/an/an/an/a



University of East Anglia

Curated by ChEMBL


Assay Description
Inhibition of alpha-1,3-GalT in bovine after 15 mins by Dixon plot analysis


J Med Chem 55: 2015-24 (2012)


Article DOI: 10.1021/jm201154p
BindingDB Entry DOI: 10.7270/Q28W3FCH
More data for this
Ligand-Target Pair
N-acetyllactosaminide alpha-1,3-galactosyltransferase


(Bos taurus)
BDBM50389787
PNG
(CHEMBL2070376)
Show SMILES OC[C@H]1O[C@H](OP(O)(=O)OP(O)(=O)OC[C@H]2O[C@H]([C@H](O)[C@@H]2O)n2cc(-c3ccco3)c(=O)[nH]c2=O)[C@H](O)[C@@H](O)[C@H]1O |r|
Show InChI InChI=1S/C19H26N2O18P2/c22-5-9-11(23)13(25)15(27)18(37-9)38-41(32,33)39-40(30,31)35-6-10-12(24)14(26)17(36-10)21-4-7(8-2-1-3-34-8)16(28)20-19(21)29/h1-4,9-15,17-18,22-27H,5-6H2,(H,30,31)(H,32,33)(H,20,28,29)/t9-,10-,11+,12-,13+,14-,15-,17-,18-/m1/s1
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
9.00E+4n/an/an/an/an/an/an/an/a



University of East Anglia

Curated by ChEMBL


Assay Description
Inhibition of alpha-1,3-GalT in bovine after 15 mins by Dixon plot analysis


J Med Chem 55: 2015-24 (2012)


Article DOI: 10.1021/jm201154p
BindingDB Entry DOI: 10.7270/Q28W3FCH
More data for this
Ligand-Target Pair