Found 73 hits with Last Name = 'booker' and Initial = 'gw' Target/Host (Institution) | Ligand | Target/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 | pH | Temp °C |
Bifunctional ligase/repressor BirA
(Escherichia coli) | BDBM50039492
(CHEMBL1231498)Show SMILES Nc1ncnc2n(cnc12)[C@@H]1O[C@H](CO[P@@](O)(=O)OCCCCC[C@@H]2SC[C@@H]3NC(=O)N[C@H]23)[C@@H](O)[C@H]1O |r| Show InChI InChI=1S/C20H30N7O8PS/c21-17-14-18(23-8-22-17)27(9-24-14)19-16(29)15(28)11(35-19)6-34-36(31,32)33-5-3-1-2-4-12-13-10(7-37-12)25-20(30)26-13/h8-13,15-16,19,28-29H,1-7H2,(H,31,32)(H2,21,22,23)(H2,25,26,30)/t10-,11+,12-,13-,15+,16+,19+/m0/s1 | PDB MMDB
KEGG
UniProtKB/SwissProt
B.MOAD DrugBank GoogleScholar AffyNet
| CHEMBL DrugBank PC cid PC sid PDB UniChem
Patents
Similars
| DrugBank PDB Article PubMed
| 87 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Adelaide
Curated by ChEMBL
| Assay Description Inhibition of Escherichia coli recombinant BPL using 3H-biotin as substrate after 10 mins by liquid scintillation counting analysis |
ACS Med Chem Lett 6: 216-20 (2015)
Article DOI: 10.1021/ml500475n BindingDB Entry DOI: 10.7270/Q2VT1TTQ |
More data for this Ligand-Target Pair | 3D Structure (crystal) |
Bifunctional ligase/repressor BirA
(Staphylococcus aureus) | BDBM92383
(Biotin triazole, 14)Show SMILES Cc1ccc2oc(=O)n(CCCCn3cc(CCCCC[C@@H]4SCC5NC(=O)NC45)nn3)c2c1 |r| Show InChI InChI=1S/C24H32N6O3S/c1-16-9-10-20-19(13-16)30(24(32)33-20)12-6-5-11-29-14-17(27-28-29)7-3-2-4-8-21-22-18(15-34-21)25-23(31)26-22/h9-10,13-14,18,21-22H,2-8,11-12,15H2,1H3,(H2,25,26,31)/t18?,21-,22?/m0/s1 | PDB
KEGG
UniProtKB/TrEMBL
B.MOAD GoogleScholar AffyNet
| PC cid PC sid UniChem
Similars
| Article PubMed
| 90 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Adelaide
| Assay Description In vitro enzyme inhibition using biotin protein ligase. |
J Biol Chem 287: 17823-32 (2012)
Article DOI: 10.1074/jbc.M112.356576 BindingDB Entry DOI: 10.7270/Q2DJ5D7V |
More data for this Ligand-Target Pair | |
Biotin--protein ligase
(Homo sapiens (Human)) | BDBM50388931
(CHEMBL2063402)Show InChI InChI=1S/C10H18N2OS/c1-2-3-4-5-8-9-7(6-14-8)11-10(13)12-9/h7-9H,2-6H2,1H3,(H2,11,12,13)/t7-,8-,9-/m0/s1 | Reactome pathway KEGG
UniProtKB/SwissProt
DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 140 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description Displacement of [3H]-biotin from human BPL after 20 mins by scintillation counting |
ACS Med Chem Lett 3: 509-514 (2012)
Article DOI: 10.1021/ml300106p BindingDB Entry DOI: 10.7270/Q2DZ09CN |
More data for this Ligand-Target Pair | |
Biotin--protein ligase
(Homo sapiens (Human)) | BDBM50039492
(CHEMBL1231498)Show SMILES Nc1ncnc2n(cnc12)[C@@H]1O[C@H](CO[P@@](O)(=O)OCCCCC[C@@H]2SC[C@@H]3NC(=O)N[C@H]23)[C@@H](O)[C@H]1O |r| Show InChI InChI=1S/C20H30N7O8PS/c21-17-14-18(23-8-22-17)27(9-24-14)19-16(29)15(28)11(35-19)6-34-36(31,32)33-5-3-1-2-4-12-13-10(7-37-12)25-20(30)26-13/h8-13,15-16,19,28-29H,1-7H2,(H,31,32)(H2,21,22,23)(H2,25,26,30)/t10-,11+,12-,13-,15+,16+,19+/m0/s1 | Reactome pathway KEGG
UniProtKB/SwissProt
DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL DrugBank PC cid PC sid PDB UniChem
Patents
Similars
| Article PubMed
| 182 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Adelaide
Curated by ChEMBL
| Assay Description Inhibition of human recombinant BPL using 3H-biotin as substrate after 10 mins by liquid scintillation counting analysis |
ACS Med Chem Lett 6: 216-20 (2015)
Article DOI: 10.1021/ml500475n BindingDB Entry DOI: 10.7270/Q2VT1TTQ |
More data for this Ligand-Target Pair | |
Biotin--protein ligase
(Homo sapiens (Human)) | BDBM50388933
(CHEMBL2063403)Show InChI InChI=1S/C11H16N2OS/c1-2-3-4-5-6-9-10-8(7-15-9)12-11(14)13-10/h1,8-10H,3-7H2,(H2,12,13,14)/t8-,9-,10-/m0/s1 | Reactome pathway KEGG
UniProtKB/SwissProt
DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL MMDB PC cid PC sid PDB UniChem
Similars
| Article PubMed
| 200 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description Displacement of [3H]-biotin from human BPL after 20 mins by scintillation counting |
ACS Med Chem Lett 3: 509-514 (2012)
Article DOI: 10.1021/ml300106p BindingDB Entry DOI: 10.7270/Q2DZ09CN |
More data for this Ligand-Target Pair | |
Bifunctional ligase/repressor BirA
(Staphylococcus aureus) | BDBM92382
(Biotin triazole, 13)Show SMILES O=C1NC2CS[C@@H](CCCCCc3cn(CCCCOc4ccc5ccccc5c4)nn3)C2N1 |r| Show InChI InChI=1S/C26H33N5O2S/c32-26-27-23-18-34-24(25(23)28-26)11-3-1-2-10-21-17-31(30-29-21)14-6-7-15-33-22-13-12-19-8-4-5-9-20(19)16-22/h4-5,8-9,12-13,16-17,23-25H,1-3,6-7,10-11,14-15,18H2,(H2,27,28,32)/t23?,24-,25?/m0/s1 | PDB
KEGG
UniProtKB/TrEMBL
B.MOAD GoogleScholar AffyNet
| PC cid PC sid UniChem
Similars
| Article PubMed
| 1.17E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Adelaide
| Assay Description In vitro enzyme inhibition using biotin protein ligase. |
J Biol Chem 287: 17823-32 (2012)
Article DOI: 10.1074/jbc.M112.356576 BindingDB Entry DOI: 10.7270/Q2DJ5D7V |
More data for this Ligand-Target Pair | |
Bifunctional ligase/repressor BirA
(Staphylococcus aureus) | BDBM92378
(Biotin triazole, 5)Show SMILES Nc1ncnc2N(CNc12)[C@@H]1O[C@H](Cn2cc(CCCCC[C@@H]3SCC4NC(=O)NC34)nn2)[C@@H](O)[C@H]1O |r| Show InChI InChI=1S/C22H32N10O4S/c23-19-16-20(25-9-24-19)32(10-26-16)21-18(34)17(33)13(36-21)7-31-6-11(29-30-31)4-2-1-3-5-14-15-12(8-37-14)27-22(35)28-15/h6,9,12-15,17-18,21,26,33-34H,1-5,7-8,10H2,(H2,23,24,25)(H2,27,28,35)/t12?,13-,14+,15?,17-,18-,21-/m1/s1 | PDB
KEGG
UniProtKB/TrEMBL
B.MOAD GoogleScholar AffyNet
| PC cid PC sid UniChem
| Article PubMed
| 1.17E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Adelaide
| Assay Description In vitro enzyme inhibition using biotin protein ligase. |
J Biol Chem 287: 17823-32 (2012)
Article DOI: 10.1074/jbc.M112.356576 BindingDB Entry DOI: 10.7270/Q2DJ5D7V |
More data for this Ligand-Target Pair | |
Biotin--protein ligase
(Homo sapiens (Human)) | BDBM50388934
(CHEMBL2063404)Show InChI InChI=1S/C12H18N2OS/c1-2-3-4-5-6-7-10-11-9(8-16-10)13-12(15)14-11/h1,9-11H,3-8H2,(H2,13,14,15)/t9-,10-,11-/m0/s1 | Reactome pathway KEGG
UniProtKB/SwissProt
DrugBank antibodypedia GoogleScholar AffyNet
| Purchase
CHEMBL MCE PC cid PC sid UniChem
Similars
| Article PubMed
| 3.50E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description Displacement of [3H]-biotin from human BPL after 20 mins by scintillation counting |
ACS Med Chem Lett 3: 509-514 (2012)
Article DOI: 10.1021/ml300106p BindingDB Entry DOI: 10.7270/Q2DZ09CN |
More data for this Ligand-Target Pair | |
Biotin--protein ligase
(Homo sapiens (Human)) | BDBM50388927
(CHEMBL2063398)Show InChI InChI=1S/C10H18N2O2S/c13-5-3-1-2-4-8-9-7(6-15-8)11-10(14)12-9/h7-9,13H,1-6H2,(H2,11,12,14)/t7-,8-,9-/m0/s1 | Reactome pathway KEGG
UniProtKB/SwissProt
DrugBank antibodypedia GoogleScholar AffyNet
| Purchase
CHEMBL MCE PC cid PC sid UniChem
Similars
| Article PubMed
| 3.85E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description Displacement of [3H]-biotin from human BPL after 20 mins by scintillation counting |
ACS Med Chem Lett 3: 509-514 (2012)
Article DOI: 10.1021/ml300106p BindingDB Entry DOI: 10.7270/Q2DZ09CN |
More data for this Ligand-Target Pair | |
Biotin--protein ligase
(Homo sapiens (Human)) | BDBM50388932
(CHEMBL2062535)Show InChI InChI=1S/C11H20N2OS/c1-2-3-4-5-6-9-10-8(7-15-9)12-11(14)13-10/h8-10H,2-7H2,1H3,(H2,12,13,14)/t8-,9-,10-/m0/s1 | Reactome pathway KEGG
UniProtKB/SwissProt
DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 6.43E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description Displacement of [3H]-biotin from human BPL after 20 mins by scintillation counting |
ACS Med Chem Lett 3: 509-514 (2012)
Article DOI: 10.1021/ml300106p BindingDB Entry DOI: 10.7270/Q2DZ09CN |
More data for this Ligand-Target Pair | |
Bifunctional ligase/repressor BirA
(Staphylococcus aureus) | BDBM92385
(Biotin triazole, 16)Show SMILES Cc1ccc2oc(=O)n(CCCn3cc(COCCC[C@@H]4SCC5NC(=O)NC45)nn3)c2c1 |r| Show InChI InChI=1S/C22H28N6O4S/c1-14-5-6-18-17(10-14)28(22(30)32-18)8-3-7-27-11-15(25-26-27)12-31-9-2-4-19-20-16(13-33-19)23-21(29)24-20/h5-6,10-11,16,19-20H,2-4,7-9,12-13H2,1H3,(H2,23,24,29)/t16?,19-,20?/m0/s1 | PDB
KEGG
UniProtKB/TrEMBL
B.MOAD GoogleScholar AffyNet
| PC cid PC sid UniChem
| Article PubMed
| >1.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Adelaide
| Assay Description In vitro enzyme inhibition using biotin protein ligase. |
J Biol Chem 287: 17823-32 (2012)
Article DOI: 10.1074/jbc.M112.356576 BindingDB Entry DOI: 10.7270/Q2DJ5D7V |
More data for this Ligand-Target Pair | |
Bifunctional ligase/repressor BirA
(Staphylococcus aureus) | BDBM92384
(Biotin triazole, 15)Show SMILES O=C1NC2CS[C@@H](CCCCCc3cn(CCCOc4ccc5ccccc5c4)nn3)C2N1 |r| Show InChI InChI=1S/C25H31N5O2S/c31-25-26-22-17-33-23(24(22)27-25)10-3-1-2-9-20-16-30(29-28-20)13-6-14-32-21-12-11-18-7-4-5-8-19(18)15-21/h4-5,7-8,11-12,15-16,22-24H,1-3,6,9-10,13-14,17H2,(H2,26,27,31)/t22?,23-,24?/m0/s1 | PDB
KEGG
UniProtKB/TrEMBL
B.MOAD GoogleScholar AffyNet
| PC cid PC sid UniChem
Similars
| Article PubMed
| >1.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Adelaide
| Assay Description In vitro enzyme inhibition using biotin protein ligase. |
J Biol Chem 287: 17823-32 (2012)
Article DOI: 10.1074/jbc.M112.356576 BindingDB Entry DOI: 10.7270/Q2DJ5D7V |
More data for this Ligand-Target Pair | |
Bifunctional ligase/repressor BirA
(Staphylococcus aureus) | BDBM92381
(Biotin triazole, 12)Show SMILES O=C1NC2CS[C@@H](CCCCCc3cn(CCCCOc4cccc5ccccc45)nn3)C2N1 |r| Show InChI InChI=1S/C26H33N5O2S/c32-26-27-22-18-34-24(25(22)28-26)14-3-1-2-11-20-17-31(30-29-20)15-6-7-16-33-23-13-8-10-19-9-4-5-12-21(19)23/h4-5,8-10,12-13,17,22,24-25H,1-3,6-7,11,14-16,18H2,(H2,27,28,32)/t22?,24-,25?/m0/s1 | PDB
KEGG
UniProtKB/TrEMBL
B.MOAD GoogleScholar AffyNet
| PC cid PC sid UniChem
Similars
| Article PubMed
| >1.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Adelaide
| Assay Description In vitro enzyme inhibition using biotin protein ligase. |
J Biol Chem 287: 17823-32 (2012)
Article DOI: 10.1074/jbc.M112.356576 BindingDB Entry DOI: 10.7270/Q2DJ5D7V |
More data for this Ligand-Target Pair | |
Bifunctional ligase/repressor BirA
(Staphylococcus aureus) | BDBM92380
(Biotin triazole, 11)Show SMILES O=C1NC2CS[C@@H](CCCCCc3cn(CCCCOc4ccccc4)nn3)C2N1 |r| Show InChI InChI=1S/C22H31N5O2S/c28-22-23-19-16-30-20(21(19)24-22)12-6-1-3-9-17-15-27(26-25-17)13-7-8-14-29-18-10-4-2-5-11-18/h2,4-5,10-11,15,19-21H,1,3,6-9,12-14,16H2,(H2,23,24,28)/t19?,20-,21?/m0/s1 | PDB
KEGG
UniProtKB/TrEMBL
B.MOAD GoogleScholar AffyNet
| PC cid PC sid UniChem
Similars
| Article PubMed
| >1.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Adelaide
| Assay Description In vitro enzyme inhibition using biotin protein ligase. |
J Biol Chem 287: 17823-32 (2012)
Article DOI: 10.1074/jbc.M112.356576 BindingDB Entry DOI: 10.7270/Q2DJ5D7V |
More data for this Ligand-Target Pair | |
Bifunctional ligase/repressor BirA
(Staphylococcus aureus) | BDBM92379
(Biotin triazole, 10)Show SMILES CC(C)(C)C(=O)OCCn1cc(CCCCC[C@@H]2SCC3NC(=O)NC23)nn1 |r| Show InChI InChI=1S/C19H31N5O3S/c1-19(2,3)17(25)27-10-9-24-11-13(22-23-24)7-5-4-6-8-15-16-14(12-28-15)20-18(26)21-16/h11,14-16H,4-10,12H2,1-3H3,(H2,20,21,26)/t14?,15-,16?/m0/s1 | PDB
KEGG
UniProtKB/TrEMBL
B.MOAD GoogleScholar AffyNet
| PC cid PC sid UniChem
| Article PubMed
| >1.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Adelaide
| Assay Description In vitro enzyme inhibition using biotin protein ligase. |
J Biol Chem 287: 17823-32 (2012)
Article DOI: 10.1074/jbc.M112.356576 BindingDB Entry DOI: 10.7270/Q2DJ5D7V |
More data for this Ligand-Target Pair | |
Biotin--protein ligase
(Homo sapiens (Human)) | BDBM50388935
(CHEMBL2063405)Show InChI InChI=1S/C13H20N2OS/c1-2-3-4-5-6-7-8-11-12-10(9-17-11)14-13(16)15-12/h1,10-12H,3-9H2,(H2,14,15,16)/t10-,11-,12-/m0/s1 | Reactome pathway KEGG
UniProtKB/SwissProt
DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 1.20E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description Displacement of [3H]-biotin from human BPL after 20 mins by scintillation counting |
ACS Med Chem Lett 3: 509-514 (2012)
Article DOI: 10.1021/ml300106p BindingDB Entry DOI: 10.7270/Q2DZ09CN |
More data for this Ligand-Target Pair | |
Biotin--protein ligase
(Homo sapiens (Human)) | BDBM50201186
(CHEMBL3923732)Show SMILES [H][C@]12CS[C@@H](CCCCCc3cn(Cc4ccccc4OC)nn3)[C@@]1([H])NC(=O)N2 |r| Show InChI InChI=1S/C20H27N5O2S/c1-27-17-9-6-5-7-14(17)11-25-12-15(23-24-25)8-3-2-4-10-18-19-16(13-28-18)21-20(26)22-19/h5-7,9,12,16,18-19H,2-4,8,10-11,13H2,1H3,(H2,21,22,26)/t16-,18-,19-/m0/s1 | Reactome pathway KEGG
UniProtKB/SwissProt
DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Patents
Similars
| Article PubMed
| >1.60E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Adelaide
Curated by ChEMBL
| Assay Description Inhibition of human biotin protein ligase assessed as reduction in 3H-biotin incorporation into pyruvate carboxylase biotin domain after 10 mins by l... |
ACS Med Chem Lett 7: 1068-1072 (2016)
Article DOI: 10.1021/acsmedchemlett.6b00248 BindingDB Entry DOI: 10.7270/Q2QV3PGF |
More data for this Ligand-Target Pair | |
Biotin--protein ligase
(Homo sapiens (Human)) | BDBM50201187
(CHEMBL3976601)Show SMILES [H][C@]12CS[C@@H](CCCCCc3cn(Cc4ccccc4Cl)nn3)[C@@]1([H])NC(=O)N2 |r| Show InChI InChI=1S/C19H24ClN5OS/c20-15-8-5-4-6-13(15)10-25-11-14(23-24-25)7-2-1-3-9-17-18-16(12-27-17)21-19(26)22-18/h4-6,8,11,16-18H,1-3,7,9-10,12H2,(H2,21,22,26)/t16-,17-,18-/m0/s1 | Reactome pathway KEGG
UniProtKB/SwissProt
DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Patents
Similars
| Article PubMed
| >1.60E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Adelaide
Curated by ChEMBL
| Assay Description Inhibition of human biotin protein ligase assessed as reduction in 3H-biotin incorporation into pyruvate carboxylase biotin domain after 10 mins by l... |
ACS Med Chem Lett 7: 1068-1072 (2016)
Article DOI: 10.1021/acsmedchemlett.6b00248 BindingDB Entry DOI: 10.7270/Q2QV3PGF |
More data for this Ligand-Target Pair | |
Biotin--protein ligase
(Homo sapiens (Human)) | BDBM50201188
(CHEMBL3891635)Show SMILES [H][C@]12CS[C@@H](CCCCCc3cn(Cc4ccc(C)cc4)nn3)[C@@]1([H])NC(=O)N2 |r| Show InChI InChI=1S/C20H27N5OS/c1-14-7-9-15(10-8-14)11-25-12-16(23-24-25)5-3-2-4-6-18-19-17(13-27-18)21-20(26)22-19/h7-10,12,17-19H,2-6,11,13H2,1H3,(H2,21,22,26)/t17-,18-,19-/m0/s1 | Reactome pathway KEGG
UniProtKB/SwissProt
DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Patents
Similars
| Article PubMed
| >1.60E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Adelaide
Curated by ChEMBL
| Assay Description Inhibition of human biotin protein ligase assessed as reduction in 3H-biotin incorporation into pyruvate carboxylase biotin domain after 10 mins by l... |
ACS Med Chem Lett 7: 1068-1072 (2016)
Article DOI: 10.1021/acsmedchemlett.6b00248 BindingDB Entry DOI: 10.7270/Q2QV3PGF |
More data for this Ligand-Target Pair | |
Biotin--protein ligase
(Homo sapiens (Human)) | BDBM50201189
(CHEMBL3984675)Show SMILES [H][C@]12CS[C@@H](CCCCCc3cn(Cc4ccc(Cl)cc4)nn3)[C@@]1([H])NC(=O)N2 |r| Show InChI InChI=1S/C19H24ClN5OS/c20-14-8-6-13(7-9-14)10-25-11-15(23-24-25)4-2-1-3-5-17-18-16(12-27-17)21-19(26)22-18/h6-9,11,16-18H,1-5,10,12H2,(H2,21,22,26)/t16-,17-,18-/m0/s1 | Reactome pathway KEGG
UniProtKB/SwissProt
DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| >1.60E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Adelaide
Curated by ChEMBL
| Assay Description Inhibition of human biotin protein ligase assessed as reduction in 3H-biotin incorporation into pyruvate carboxylase biotin domain after 10 mins by l... |
ACS Med Chem Lett 7: 1068-1072 (2016)
Article DOI: 10.1021/acsmedchemlett.6b00248 BindingDB Entry DOI: 10.7270/Q2QV3PGF |
More data for this Ligand-Target Pair | |
Biotin--protein ligase
(Homo sapiens (Human)) | BDBM50201190
(CHEMBL3942705)Show SMILES [H][C@]12CS[C@@H](CCCCCc3cn(Cc4ccccc4N)nn3)[C@@]1([H])NC(=O)N2 |r| Show InChI InChI=1S/C19H26N6OS/c20-15-8-5-4-6-13(15)10-25-11-14(23-24-25)7-2-1-3-9-17-18-16(12-27-17)21-19(26)22-18/h4-6,8,11,16-18H,1-3,7,9-10,12,20H2,(H2,21,22,26)/t16-,17-,18-/m0/s1 | Reactome pathway KEGG
UniProtKB/SwissProt
DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Patents
Similars
| Article PubMed
| >1.60E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Adelaide
Curated by ChEMBL
| Assay Description Inhibition of human biotin protein ligase assessed as reduction in 3H-biotin incorporation into pyruvate carboxylase biotin domain after 10 mins by l... |
ACS Med Chem Lett 7: 1068-1072 (2016)
Article DOI: 10.1021/acsmedchemlett.6b00248 BindingDB Entry DOI: 10.7270/Q2QV3PGF |
More data for this Ligand-Target Pair | |
Biotin--protein ligase
(Homo sapiens (Human)) | BDBM50201191
(CHEMBL3951442)Show SMILES [H][C@]12CS[C@@H](CCCCCc3cn(Cc4cccc(OC)c4)nn3)[C@@]1([H])NC(=O)N2 |r| Show InChI InChI=1S/C20H27N5O2S/c1-27-16-8-5-6-14(10-16)11-25-12-15(23-24-25)7-3-2-4-9-18-19-17(13-28-18)21-20(26)22-19/h5-6,8,10,12,17-19H,2-4,7,9,11,13H2,1H3,(H2,21,22,26)/t17-,18-,19-/m0/s1 | Reactome pathway KEGG
UniProtKB/SwissProt
DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| >1.60E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Adelaide
Curated by ChEMBL
| Assay Description Inhibition of human biotin protein ligase assessed as reduction in 3H-biotin incorporation into pyruvate carboxylase biotin domain after 10 mins by l... |
ACS Med Chem Lett 7: 1068-1072 (2016)
Article DOI: 10.1021/acsmedchemlett.6b00248 BindingDB Entry DOI: 10.7270/Q2QV3PGF |
More data for this Ligand-Target Pair | |
Biotin--protein ligase
(Homo sapiens (Human)) | BDBM50201192
(CHEMBL3932681)Show SMILES [H][C@]12CS[C@@H](CCCCCc3cn(Cc4cccc(O)c4)nn3)[C@@]1([H])NC(=O)N2 |r| Show InChI InChI=1S/C19H25N5O2S/c25-15-7-4-5-13(9-15)10-24-11-14(22-23-24)6-2-1-3-8-17-18-16(12-27-17)20-19(26)21-18/h4-5,7,9,11,16-18,25H,1-3,6,8,10,12H2,(H2,20,21,26)/t16-,17-,18-/m0/s1 | Reactome pathway KEGG
UniProtKB/SwissProt
DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Patents
Similars
| Article PubMed
| >1.60E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Adelaide
Curated by ChEMBL
| Assay Description Inhibition of human biotin protein ligase assessed as reduction in 3H-biotin incorporation into pyruvate carboxylase biotin domain after 10 mins by l... |
ACS Med Chem Lett 7: 1068-1072 (2016)
Article DOI: 10.1021/acsmedchemlett.6b00248 BindingDB Entry DOI: 10.7270/Q2QV3PGF |
More data for this Ligand-Target Pair | |
Biotin--protein ligase
(Homo sapiens (Human)) | BDBM50201193
(CHEMBL3974372)Show SMILES [H][C@]12CS[C@@H](CCCCCc3cn(Cc4cccc(C)c4)nn3)[C@@]1([H])NC(=O)N2 |r| Show InChI InChI=1S/C20H27N5OS/c1-14-6-5-7-15(10-14)11-25-12-16(23-24-25)8-3-2-4-9-18-19-17(13-27-18)21-20(26)22-19/h5-7,10,12,17-19H,2-4,8-9,11,13H2,1H3,(H2,21,22,26)/t17-,18-,19-/m0/s1 | Reactome pathway KEGG
UniProtKB/SwissProt
DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Patents
Similars
| Article PubMed
| >1.60E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Adelaide
Curated by ChEMBL
| Assay Description Inhibition of human biotin protein ligase assessed as reduction in 3H-biotin incorporation into pyruvate carboxylase biotin domain after 10 mins by l... |
ACS Med Chem Lett 7: 1068-1072 (2016)
Article DOI: 10.1021/acsmedchemlett.6b00248 BindingDB Entry DOI: 10.7270/Q2QV3PGF |
More data for this Ligand-Target Pair | |
Biotin--protein ligase
(Homo sapiens (Human)) | BDBM50201194
(CHEMBL3932600)Show SMILES [H][C@]12CS[C@@H](CCCCCc3cn(Cc4ccc(cc4)C(F)(F)F)nn3)[C@@]1([H])NC(=O)N2 |r| Show InChI InChI=1S/C20H24F3N5OS/c21-20(22,23)14-8-6-13(7-9-14)10-28-11-15(26-27-28)4-2-1-3-5-17-18-16(12-30-17)24-19(29)25-18/h6-9,11,16-18H,1-5,10,12H2,(H2,24,25,29)/t16-,17-,18-/m0/s1 | Reactome pathway KEGG
UniProtKB/SwissProt
DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| >1.60E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Adelaide
Curated by ChEMBL
| Assay Description Inhibition of human biotin protein ligase assessed as reduction in 3H-biotin incorporation into pyruvate carboxylase biotin domain after 10 mins by l... |
ACS Med Chem Lett 7: 1068-1072 (2016)
Article DOI: 10.1021/acsmedchemlett.6b00248 BindingDB Entry DOI: 10.7270/Q2QV3PGF |
More data for this Ligand-Target Pair | |
Biotin--protein ligase
(Homo sapiens (Human)) | BDBM50201195
(CHEMBL3972792)Show SMILES [H][C@]12CS[C@@H](CCCCCc3cn(Cc4ccc(cc4)C(O)=O)nn3)[C@@]1([H])NC(=O)N2 |r| Show InChI InChI=1S/C20H25N5O3S/c26-19(27)14-8-6-13(7-9-14)10-25-11-15(23-24-25)4-2-1-3-5-17-18-16(12-29-17)21-20(28)22-18/h6-9,11,16-18H,1-5,10,12H2,(H,26,27)(H2,21,22,28)/t16-,17-,18-/m0/s1 | Reactome pathway KEGG
UniProtKB/SwissProt
DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid PDB UniChem
Patents
Similars
| Article PubMed
| >1.60E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Adelaide
Curated by ChEMBL
| Assay Description Inhibition of human biotin protein ligase assessed as reduction in 3H-biotin incorporation into pyruvate carboxylase biotin domain after 10 mins by l... |
ACS Med Chem Lett 7: 1068-1072 (2016)
Article DOI: 10.1021/acsmedchemlett.6b00248 BindingDB Entry DOI: 10.7270/Q2QV3PGF |
More data for this Ligand-Target Pair | |
Biotin--protein ligase
(Homo sapiens (Human)) | BDBM50201196
(CHEMBL3961751)Show SMILES [H][C@]12CS[C@@H](CCCCCc3cn(Cc4cccc(I)c4)nn3)[C@@]1([H])NC(=O)N2 |r| Show InChI InChI=1S/C19H24IN5OS/c20-14-6-4-5-13(9-14)10-25-11-15(23-24-25)7-2-1-3-8-17-18-16(12-27-17)21-19(26)22-18/h4-6,9,11,16-18H,1-3,7-8,10,12H2,(H2,21,22,26)/t16-,17-,18-/m0/s1 | Reactome pathway KEGG
UniProtKB/SwissProt
DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Patents
Similars
| Article PubMed
| >1.60E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Adelaide
Curated by ChEMBL
| Assay Description Inhibition of human biotin protein ligase assessed as reduction in 3H-biotin incorporation into pyruvate carboxylase biotin domain after 10 mins by l... |
ACS Med Chem Lett 7: 1068-1072 (2016)
Article DOI: 10.1021/acsmedchemlett.6b00248 BindingDB Entry DOI: 10.7270/Q2QV3PGF |
More data for this Ligand-Target Pair | |
Biotin--protein ligase
(Homo sapiens (Human)) | BDBM50201197
(CHEMBL3895686)Show SMILES [H][C@]12CS[C@@H](CCCCCc3cn(Cc4ccc(I)cc4)nn3)[C@@]1([H])NC(=O)N2 |r| Show InChI InChI=1S/C19H24IN5OS/c20-14-8-6-13(7-9-14)10-25-11-15(23-24-25)4-2-1-3-5-17-18-16(12-27-17)21-19(26)22-18/h6-9,11,16-18H,1-5,10,12H2,(H2,21,22,26)/t16-,17-,18-/m0/s1 | Reactome pathway KEGG
UniProtKB/SwissProt
DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| >1.60E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Adelaide
Curated by ChEMBL
| Assay Description Inhibition of human biotin protein ligase assessed as reduction in 3H-biotin incorporation into pyruvate carboxylase biotin domain after 10 mins by l... |
ACS Med Chem Lett 7: 1068-1072 (2016)
Article DOI: 10.1021/acsmedchemlett.6b00248 BindingDB Entry DOI: 10.7270/Q2QV3PGF |
More data for this Ligand-Target Pair | |
Biotin--protein ligase
(Homo sapiens (Human)) | BDBM50201198
(CHEMBL3968104)Show SMILES [H][C@]12CS[C@@H](CCCCCc3cn(Cc4cccc(F)c4)nn3)[C@@]1([H])NC(=O)N2 |r| Show InChI InChI=1S/C19H24FN5OS/c20-14-6-4-5-13(9-14)10-25-11-15(23-24-25)7-2-1-3-8-17-18-16(12-27-17)21-19(26)22-18/h4-6,9,11,16-18H,1-3,7-8,10,12H2,(H2,21,22,26)/t16-,17-,18-/m0/s1 | Reactome pathway KEGG
UniProtKB/SwissProt
DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid PDB UniChem
Patents
Similars
| Article PubMed
| >1.60E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Adelaide
Curated by ChEMBL
| Assay Description Inhibition of human biotin protein ligase assessed as reduction in 3H-biotin incorporation into pyruvate carboxylase biotin domain after 10 mins by l... |
ACS Med Chem Lett 7: 1068-1072 (2016)
Article DOI: 10.1021/acsmedchemlett.6b00248 BindingDB Entry DOI: 10.7270/Q2QV3PGF |
More data for this Ligand-Target Pair | |
Biotin--protein ligase
(Homo sapiens (Human)) | BDBM50201199
(CHEMBL3934430)Show SMILES [H][C@]12CS[C@@H](CCCCCc3cn(Cc4ccc(F)cc4)nn3)[C@@]1([H])NC(=O)N2 |r| Show InChI InChI=1S/C19H24FN5OS/c20-14-8-6-13(7-9-14)10-25-11-15(23-24-25)4-2-1-3-5-17-18-16(12-27-17)21-19(26)22-18/h6-9,11,16-18H,1-5,10,12H2,(H2,21,22,26)/t16-,17-,18-/m0/s1 | Reactome pathway KEGG
UniProtKB/SwissProt
DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| >1.60E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Adelaide
Curated by ChEMBL
| Assay Description Inhibition of human biotin protein ligase assessed as reduction in 3H-biotin incorporation into pyruvate carboxylase biotin domain after 10 mins by l... |
ACS Med Chem Lett 7: 1068-1072 (2016)
Article DOI: 10.1021/acsmedchemlett.6b00248 BindingDB Entry DOI: 10.7270/Q2QV3PGF |
More data for this Ligand-Target Pair | |
Biotin--protein ligase
(Homo sapiens (Human)) | BDBM50201200
(CHEMBL3905875)Show SMILES [H][C@]12CS[C@@H](CCCCCc3cn(Cc4cccc(Cl)c4)nn3)[C@@]1([H])NC(=O)N2 |r| Show InChI InChI=1S/C19H24ClN5OS/c20-14-6-4-5-13(9-14)10-25-11-15(23-24-25)7-2-1-3-8-17-18-16(12-27-17)21-19(26)22-18/h4-6,9,11,16-18H,1-3,7-8,10,12H2,(H2,21,22,26)/t16-,17-,18-/m0/s1 | Reactome pathway KEGG
UniProtKB/SwissProt
DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Patents
Similars
| Article PubMed
| >1.60E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Adelaide
Curated by ChEMBL
| Assay Description Inhibition of human biotin protein ligase assessed as reduction in 3H-biotin incorporation into pyruvate carboxylase biotin domain after 10 mins by l... |
ACS Med Chem Lett 7: 1068-1072 (2016)
Article DOI: 10.1021/acsmedchemlett.6b00248 BindingDB Entry DOI: 10.7270/Q2QV3PGF |
More data for this Ligand-Target Pair | |
Biotin--protein ligase
(Homo sapiens (Human)) | BDBM50201201
(CHEMBL3901708)Show SMILES [H][C@]12CS[C@@H](CCCCCc3cn(Cc4ccc(cc4)C(C)(C)C)nn3)[C@@]1([H])NC(=O)N2 |r| Show InChI InChI=1S/C23H33N5OS/c1-23(2,3)17-11-9-16(10-12-17)13-28-14-18(26-27-28)7-5-4-6-8-20-21-19(15-30-20)24-22(29)25-21/h9-12,14,19-21H,4-8,13,15H2,1-3H3,(H2,24,25,29)/t19-,20-,21-/m0/s1 | Reactome pathway KEGG
UniProtKB/SwissProt
DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| >1.60E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Adelaide
Curated by ChEMBL
| Assay Description Inhibition of human biotin protein ligase assessed as reduction in 3H-biotin incorporation into pyruvate carboxylase biotin domain after 10 mins by l... |
ACS Med Chem Lett 7: 1068-1072 (2016)
Article DOI: 10.1021/acsmedchemlett.6b00248 BindingDB Entry DOI: 10.7270/Q2QV3PGF |
More data for this Ligand-Target Pair | |
Biotin--protein ligase
(Homo sapiens (Human)) | BDBM50201202
(CHEMBL3971239)Show SMILES [H][C@]12CS[C@@H](CCCCCc3cn(Cc4ccccc4O)nn3)[C@@]1([H])NC(=O)N2 |r| Show InChI InChI=1S/C19H25N5O2S/c25-16-8-5-4-6-13(16)10-24-11-14(22-23-24)7-2-1-3-9-17-18-15(12-27-17)20-19(26)21-18/h4-6,8,11,15,17-18,25H,1-3,7,9-10,12H2,(H2,20,21,26)/t15-,17-,18-/m0/s1 | Reactome pathway KEGG
UniProtKB/SwissProt
DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Patents
Similars
| Article PubMed
| >1.60E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Adelaide
Curated by ChEMBL
| Assay Description Inhibition of human biotin protein ligase assessed as reduction in 3H-biotin incorporation into pyruvate carboxylase biotin domain after 10 mins by l... |
ACS Med Chem Lett 7: 1068-1072 (2016)
Article DOI: 10.1021/acsmedchemlett.6b00248 BindingDB Entry DOI: 10.7270/Q2QV3PGF |
More data for this Ligand-Target Pair | |
Biotin--protein ligase
(Homo sapiens (Human)) | BDBM50201203
(CHEMBL3905724)Show SMILES [H][C@]12CS[C@@H](CCCCCc3cn(Cc4cccc(N)c4)nn3)[C@@]1([H])NC(=O)N2 |r| Show InChI InChI=1S/C19H26N6OS/c20-14-6-4-5-13(9-14)10-25-11-15(23-24-25)7-2-1-3-8-17-18-16(12-27-17)21-19(26)22-18/h4-6,9,11,16-18H,1-3,7-8,10,12,20H2,(H2,21,22,26)/t16-,17-,18-/m0/s1 | Reactome pathway KEGG
UniProtKB/SwissProt
DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| >1.60E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Adelaide
Curated by ChEMBL
| Assay Description Inhibition of human biotin protein ligase assessed as reduction in 3H-biotin incorporation into pyruvate carboxylase biotin domain after 10 mins by l... |
ACS Med Chem Lett 7: 1068-1072 (2016)
Article DOI: 10.1021/acsmedchemlett.6b00248 BindingDB Entry DOI: 10.7270/Q2QV3PGF |
More data for this Ligand-Target Pair | |
Biotin--protein ligase
(Homo sapiens (Human)) | BDBM50201204
(CHEMBL3927537)Show SMILES [H][C@]12CS[C@@H](CCCCCc3cn(Cc4ccccc4F)nn3)[C@@]1([H])NC(=O)N2 |r| Show InChI InChI=1S/C19H24FN5OS/c20-15-8-5-4-6-13(15)10-25-11-14(23-24-25)7-2-1-3-9-17-18-16(12-27-17)21-19(26)22-18/h4-6,8,11,16-18H,1-3,7,9-10,12H2,(H2,21,22,26)/t16-,17-,18-/m0/s1 | Reactome pathway KEGG
UniProtKB/SwissProt
DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Patents
Similars
| Article PubMed
| >1.60E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Adelaide
Curated by ChEMBL
| Assay Description Inhibition of human biotin protein ligase assessed as reduction in 3H-biotin incorporation into pyruvate carboxylase biotin domain after 10 mins by l... |
ACS Med Chem Lett 7: 1068-1072 (2016)
Article DOI: 10.1021/acsmedchemlett.6b00248 BindingDB Entry DOI: 10.7270/Q2QV3PGF |
More data for this Ligand-Target Pair | |
Biotin--protein ligase
(Homo sapiens (Human)) | BDBM50201205
(CHEMBL3914706)Show SMILES [H][C@]12CS[C@@H](CCCCCc3cn(Cc4ccc(OC)cc4)nn3)[C@@]1([H])NC(=O)N2 |r| Show InChI InChI=1S/C20H27N5O2S/c1-27-16-9-7-14(8-10-16)11-25-12-15(23-24-25)5-3-2-4-6-18-19-17(13-28-18)21-20(26)22-19/h7-10,12,17-19H,2-6,11,13H2,1H3,(H2,21,22,26)/t17-,18-,19-/m0/s1 | Reactome pathway KEGG
UniProtKB/SwissProt
DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| >1.60E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Adelaide
Curated by ChEMBL
| Assay Description Inhibition of human biotin protein ligase assessed as reduction in 3H-biotin incorporation into pyruvate carboxylase biotin domain after 10 mins by l... |
ACS Med Chem Lett 7: 1068-1072 (2016)
Article DOI: 10.1021/acsmedchemlett.6b00248 BindingDB Entry DOI: 10.7270/Q2QV3PGF |
More data for this Ligand-Target Pair | |
Biotin--protein ligase
(Homo sapiens (Human)) | BDBM50201206
(CHEMBL3960176)Show SMILES [H][C@]12CS[C@@H](CCCCCc3cn(Cc4ccc(O)cc4)nn3)[C@@]1([H])NC(=O)N2 |r| Show InChI InChI=1S/C19H25N5O2S/c25-15-8-6-13(7-9-15)10-24-11-14(22-23-24)4-2-1-3-5-17-18-16(12-27-17)20-19(26)21-18/h6-9,11,16-18,25H,1-5,10,12H2,(H2,20,21,26)/t16-,17-,18-/m0/s1 | Reactome pathway KEGG
UniProtKB/SwissProt
DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| >1.60E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Adelaide
Curated by ChEMBL
| Assay Description Inhibition of human biotin protein ligase assessed as reduction in 3H-biotin incorporation into pyruvate carboxylase biotin domain after 10 mins by l... |
ACS Med Chem Lett 7: 1068-1072 (2016)
Article DOI: 10.1021/acsmedchemlett.6b00248 BindingDB Entry DOI: 10.7270/Q2QV3PGF |
More data for this Ligand-Target Pair | |
Biotin--protein ligase
(Homo sapiens (Human)) | BDBM50201207
(CHEMBL3910734)Show SMILES [H][C@]12CS[C@@H](CCCCCc3cn(Cc4cccc(c4)C(F)(F)F)nn3)[C@@]1([H])NC(=O)N2 |r| Show InChI InChI=1S/C20H24F3N5OS/c21-20(22,23)14-6-4-5-13(9-14)10-28-11-15(26-27-28)7-2-1-3-8-17-18-16(12-30-17)24-19(29)25-18/h4-6,9,11,16-18H,1-3,7-8,10,12H2,(H2,24,25,29)/t16-,17-,18-/m0/s1 | Reactome pathway KEGG
UniProtKB/SwissProt
DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| >1.60E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Adelaide
Curated by ChEMBL
| Assay Description Inhibition of human biotin protein ligase assessed as reduction in 3H-biotin incorporation into pyruvate carboxylase biotin domain after 10 mins by l... |
ACS Med Chem Lett 7: 1068-1072 (2016)
Article DOI: 10.1021/acsmedchemlett.6b00248 BindingDB Entry DOI: 10.7270/Q2QV3PGF |
More data for this Ligand-Target Pair | |
Biotin--protein ligase
(Homo sapiens (Human)) | BDBM50201208
(CHEMBL3892750)Show SMILES [H][C@]12CS[C@@H](CCCCCc3cn(Cc4ccccc4Br)nn3)[C@@]1([H])NC(=O)N2 |r| Show InChI InChI=1S/C19H24BrN5OS/c20-15-8-5-4-6-13(15)10-25-11-14(23-24-25)7-2-1-3-9-17-18-16(12-27-17)21-19(26)22-18/h4-6,8,11,16-18H,1-3,7,9-10,12H2,(H2,21,22,26)/t16-,17-,18-/m0/s1 | Reactome pathway KEGG
UniProtKB/SwissProt
DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| >1.60E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Adelaide
Curated by ChEMBL
| Assay Description Inhibition of human biotin protein ligase assessed as reduction in 3H-biotin incorporation into pyruvate carboxylase biotin domain after 10 mins by l... |
ACS Med Chem Lett 7: 1068-1072 (2016)
Article DOI: 10.1021/acsmedchemlett.6b00248 BindingDB Entry DOI: 10.7270/Q2QV3PGF |
More data for this Ligand-Target Pair | |
Biotin--protein ligase
(Homo sapiens (Human)) | BDBM50201209
(CHEMBL3914868)Show SMILES [H][C@]12CS[C@@H](CCCCCc3cn(Cc4ccc(F)c(F)c4)nn3)[C@@]1([H])NC(=O)N2 |r| Show InChI InChI=1S/C19H23F2N5OS/c20-14-7-6-12(8-15(14)21)9-26-10-13(24-25-26)4-2-1-3-5-17-18-16(11-28-17)22-19(27)23-18/h6-8,10,16-18H,1-5,9,11H2,(H2,22,23,27)/t16-,17-,18-/m0/s1 | Reactome pathway KEGG
UniProtKB/SwissProt
DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Patents
Similars
| Article PubMed
| >1.60E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Adelaide
Curated by ChEMBL
| Assay Description Inhibition of human biotin protein ligase assessed as reduction in 3H-biotin incorporation into pyruvate carboxylase biotin domain after 10 mins by l... |
ACS Med Chem Lett 7: 1068-1072 (2016)
Article DOI: 10.1021/acsmedchemlett.6b00248 BindingDB Entry DOI: 10.7270/Q2QV3PGF |
More data for this Ligand-Target Pair | |
Biotin--protein ligase
(Homo sapiens (Human)) | BDBM50201210
(CHEMBL3933745)Show SMILES [H][C@]12CS[C@@H](CCCCCc3cn(Cc4ccc(N)cc4)nn3)[C@@]1([H])NC(=O)N2 |r| Show InChI InChI=1S/C19H26N6OS/c20-14-8-6-13(7-9-14)10-25-11-15(23-24-25)4-2-1-3-5-17-18-16(12-27-17)21-19(26)22-18/h6-9,11,16-18H,1-5,10,12,20H2,(H2,21,22,26)/t16-,17-,18-/m0/s1 | Reactome pathway KEGG
UniProtKB/SwissProt
DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Patents
Similars
| Article PubMed
| >1.60E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Adelaide
Curated by ChEMBL
| Assay Description Inhibition of human biotin protein ligase assessed as reduction in 3H-biotin incorporation into pyruvate carboxylase biotin domain after 10 mins by l... |
ACS Med Chem Lett 7: 1068-1072 (2016)
Article DOI: 10.1021/acsmedchemlett.6b00248 BindingDB Entry DOI: 10.7270/Q2QV3PGF |
More data for this Ligand-Target Pair | |
Biotin--protein ligase
(Homo sapiens (Human)) | BDBM50388929
(CHEMBL2063400)Show InChI InChI=1S/C9H17N3OS/c10-4-2-1-3-7-8-6(5-14-7)11-9(13)12-8/h6-8H,1-5,10H2,(H2,11,12,13)/t6-,7-,8-/m0/s1 | Reactome pathway KEGG
UniProtKB/SwissProt
DrugBank antibodypedia GoogleScholar AffyNet
| Purchase
CHEMBL MCE PC cid PC sid UniChem
Similars
| Article PubMed
| >2.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description Displacement of [3H]-biotin from human BPL after 20 mins by scintillation counting |
ACS Med Chem Lett 3: 509-514 (2012)
Article DOI: 10.1021/ml300106p BindingDB Entry DOI: 10.7270/Q2DZ09CN |
More data for this Ligand-Target Pair | |
Biotin--protein ligase
(Homo sapiens (Human)) | BDBM50388928
(CHEMBL2063399)Show InChI InChI=1S/C11H20N2O2S/c14-6-4-2-1-3-5-9-10-8(7-16-9)12-11(15)13-10/h8-10,14H,1-7H2,(H2,12,13,15)/t8-,9-,10-/m0/s1 | Reactome pathway KEGG
UniProtKB/SwissProt
DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| >2.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description Displacement of [3H]-biotin from human BPL after 20 mins by scintillation counting |
ACS Med Chem Lett 3: 509-514 (2012)
Article DOI: 10.1021/ml300106p BindingDB Entry DOI: 10.7270/Q2DZ09CN |
More data for this Ligand-Target Pair | |
Biotin--protein ligase
(Homo sapiens (Human)) | BDBM50388930
(CHEMBL2063401)Show InChI InChI=1S/C10H19N3OS/c11-5-3-1-2-4-8-9-7(6-15-8)12-10(14)13-9/h7-9H,1-6,11H2,(H2,12,13,14)/t7-,8-,9-/m0/s1 | Reactome pathway KEGG
UniProtKB/SwissProt
DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| >2.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description Displacement of [3H]-biotin from human BPL after 20 mins by scintillation counting |
ACS Med Chem Lett 3: 509-514 (2012)
Article DOI: 10.1021/ml300106p BindingDB Entry DOI: 10.7270/Q2DZ09CN |
More data for this Ligand-Target Pair | |
Tyrosine-protein kinase
(Mus musculus) | BDBM50154584
(6-Fluoro-quinolin-2-ylamine | CHEMBL185917)Show InChI InChI=1S/C9H7FN2/c10-7-2-3-8-6(5-7)1-4-9(11)12-8/h1-5H,(H2,11,12) | PDB
UniProtKB/SwissProt
B.MOAD GoogleScholar AffyNet
| Purchase
CHEMBL PC cid PC sid UniChem
| Article PubMed
| n/a | n/a | n/a | n/a | 1.50E+5 | n/a | n/a | n/a | n/a |
The University of Adelaide
Curated by ChEMBL
| Assay Description Displacement of PRP-1 peptide from mouse Tec kinase SH3 domain by fluorescence polarization |
J Med Chem 47: 5405-17 (2004)
Article DOI: 10.1021/jm049533z BindingDB Entry DOI: 10.7270/Q26M369B |
More data for this Ligand-Target Pair | |
Tyrosine-protein kinase
(Mus musculus) | BDBM50154585
(CHEMBL187951 | Quinazolin-2-ylamine)Show InChI InChI=1S/C8H7N3/c9-8-10-5-6-3-1-2-4-7(6)11-8/h1-5H,(H2,9,10,11) | PDB
UniProtKB/SwissProt
B.MOAD GoogleScholar AffyNet
| Purchase
CHEMBL MCE PC cid PC sid UniChem
Patents
Similars
| Article PubMed
| n/a | n/a | n/a | 8.00E+5 | n/a | n/a | n/a | n/a | n/a |
The University of Adelaide
Curated by ChEMBL
| Assay Description Displacement of PRP-1 peptide from mouse Tec kinase SH3 domain by fluorescence polarization |
J Med Chem 47: 5405-17 (2004)
Article DOI: 10.1021/jm049533z BindingDB Entry DOI: 10.7270/Q26M369B |
More data for this Ligand-Target Pair | |
Tyrosine-protein kinase
(Mus musculus) | BDBM50154586
(6-(5,5-Dimethyl-[1,3]dioxan-2-yl)-quinolin-2-ylami...)Show InChI InChI=1S/C15H18N2O2/c1-15(2)8-18-14(19-9-15)11-3-5-12-10(7-11)4-6-13(16)17-12/h3-7,14H,8-9H2,1-2H3,(H2,16,17) | PDB
UniProtKB/SwissProt
B.MOAD GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | n/a | 2.20E+4 | n/a | n/a | n/a | n/a | n/a |
The University of Adelaide
Curated by ChEMBL
| Assay Description Displacement of PRP-1 peptide from mouse Tec kinase SH3 domain by fluorescence polarization |
J Med Chem 47: 5405-17 (2004)
Article DOI: 10.1021/jm049533z BindingDB Entry DOI: 10.7270/Q26M369B |
More data for this Ligand-Target Pair | |
Tyrosine-protein kinase HCK
(Homo sapiens (Human)) | BDBM14322
(2-Aminoquinoline 1 | 2-aminoquinoline | CHEMBL6123...)Show InChI InChI=1S/C9H8N2/c10-9-6-5-7-3-1-2-4-8(7)11-9/h1-6H,(H2,10,11) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| Purchase
CHEMBL MCE MMDB PC cid PC sid PDB UniChem
Patents
Similars
| Article PubMed
| n/a | n/a | n/a | n/a | >1.00E+6 | n/a | n/a | n/a | n/a |
The University of Adelaide
Curated by ChEMBL
| Assay Description Displacement of PRP-2 peptide from human Hck kinase SH3 domain by fluorescence polarization |
J Med Chem 47: 5405-17 (2004)
Article DOI: 10.1021/jm049533z BindingDB Entry DOI: 10.7270/Q26M369B |
More data for this Ligand-Target Pair | |
Tyrosine-protein kinase
(Mus musculus) | BDBM50154583
(6-Methyl-quinolin-2-ylamine | CHEMBL361660)Show InChI InChI=1S/C10H10N2/c1-7-2-4-9-8(6-7)3-5-10(11)12-9/h2-6H,1H3,(H2,11,12) | PDB
UniProtKB/SwissProt
B.MOAD GoogleScholar AffyNet
| Purchase
CHEMBL MCE PC cid PC sid UniChem
Patents
Similars
| Article PubMed
| n/a | n/a | n/a | n/a | 7.50E+4 | n/a | n/a | n/a | n/a |
The University of Adelaide
Curated by ChEMBL
| Assay Description Displacement of PRP-1 peptide from mouse Tec kinase SH3 domain by fluorescence polarization |
J Med Chem 47: 5405-17 (2004)
Article DOI: 10.1021/jm049533z BindingDB Entry DOI: 10.7270/Q26M369B |
More data for this Ligand-Target Pair | |
Cytoplasmic protein NCK1
(Homo sapiens (Human)) | BDBM50154582
(6-[1,3]Dioxan-2-yl-quinolin-2-ylamine | CHEMBL4266...)Show InChI InChI=1S/C13H14N2O2/c14-12-5-3-9-8-10(2-4-11(9)15-12)13-16-6-1-7-17-13/h2-5,8,13H,1,6-7H2,(H2,14,15) | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | n/a | n/a | >5.00E+5 | n/a | n/a | n/a | n/a |
The University of Adelaide
Curated by ChEMBL
| Assay Description Displacement of PRP-1 peptide from human Nck kinase SH3 domain by fluorescence polarization |
J Med Chem 47: 5405-17 (2004)
Article DOI: 10.1021/jm049533z BindingDB Entry DOI: 10.7270/Q26M369B |
More data for this Ligand-Target Pair | |