Found 41 hits of affinity data for UniProtKB/TrEMBL: P50747 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 |
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 | |
Biotin--protein ligase
(Homo sapiens (Human)) | BDBM50039493
(CHEMBL3357333)Show SMILES [NH4+].[H][C@]12CS[C@@H](CCCCC(=O)CP([O-])(=O)OC[C@H]3O[C@H]([C@H](O)[C@@H]3O)n3cnc4c(N)ncnc34)[C@@]1([H])NC(=O)N2 |r| Show InChI InChI=1S/C21H30N7O8PS/c22-18-15-19(24-8-23-18)28(9-25-15)20-17(31)16(30)12(36-20)5-35-37(33,34)6-10(29)3-1-2-4-13-14-11(7-38-13)26-21(32)27-14/h8-9,11-14,16-17,20,30-31H,1-7H2,(H,33,34)(H2,22,23,24)(H2,26,27,32)/p-1/t11-,12+,13-,14-,16+,17+,20+/m0/s1 | Reactome pathway KEGG
UniProtKB/SwissProt
DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Patents
Similars
| Article PubMed
| 2.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Nebraska-Lincoln
Curated by ChEMBL
| Assay Description Inhibition of human recombinant HLCS using P67 as substrate after 2 hrs relative to vehicle-treated control |
Bioorg Med Chem Lett 24: 5568-71 (2014)
Article DOI: 10.1016/j.bmcl.2014.11.010 BindingDB Entry DOI: 10.7270/Q2W097KM |
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 | |
Biotin--protein ligase
(Homo sapiens (Human)) | BDBM50039494
(CHEMBL3357334)Show SMILES [NH4+].[H][C@]12CS[C@@H](CCCCC(O)CP([O-])(=O)OC[C@H]3O[C@H]([C@H](O)[C@@H]3O)n3cnc4c(N)ncnc34)[C@@]1([H])NC(=O)N2 |r| Show InChI InChI=1S/C21H32N7O8PS/c22-18-15-19(24-8-23-18)28(9-25-15)20-17(31)16(30)12(36-20)5-35-37(33,34)6-10(29)3-1-2-4-13-14-11(7-38-13)26-21(32)27-14/h8-14,16-17,20,29-31H,1-7H2,(H,33,34)(H2,22,23,24)(H2,26,27,32)/p-1/t10?,11-,12+,13-,14-,16+,17+,20+/m0/s1 | Reactome pathway KEGG
UniProtKB/SwissProt
DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Patents
Similars
| Article PubMed
| 1.04E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Nebraska-Lincoln
Curated by ChEMBL
| Assay Description Inhibition of human recombinant HLCS using P67 as substrate after 2 hrs relative to vehicle-treated control |
Bioorg Med Chem Lett 24: 5568-71 (2014)
Article DOI: 10.1016/j.bmcl.2014.11.010 BindingDB Entry DOI: 10.7270/Q2W097KM |
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)) | 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)) | 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)) | 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)) | 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)) | 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)) | 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)) | 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)) | 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)) | 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)) | 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)) | 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)) | 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)) | 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)) | 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)) | 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 | |
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)) | 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
| 7.54E+5 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Nebraska-Lincoln
Curated by ChEMBL
| Assay Description Inhibition of human recombinant HLCS using P67 as substrate after 2 hrs relative to vehicle-treated control |
Bioorg Med Chem Lett 24: 5568-71 (2014)
Article DOI: 10.1016/j.bmcl.2014.11.010 BindingDB Entry DOI: 10.7270/Q2W097KM |
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
| n/a | n/a | 8.80E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Nebraska-Lincoln
Curated by ChEMBL
| Assay Description Inhibition of human recombinant HLCS using P67 as substrate after 2 hrs relative to vehicle-treated control |
Bioorg Med Chem Lett 24: 5568-71 (2014)
Article DOI: 10.1016/j.bmcl.2014.11.010 BindingDB Entry DOI: 10.7270/Q2W097KM |
More data for this Ligand-Target Pair | |
Biotin--protein ligase
(Homo sapiens (Human)) | BDBM50039493
(CHEMBL3357333)Show SMILES [NH4+].[H][C@]12CS[C@@H](CCCCC(=O)CP([O-])(=O)OC[C@H]3O[C@H]([C@H](O)[C@@H]3O)n3cnc4c(N)ncnc34)[C@@]1([H])NC(=O)N2 |r| Show InChI InChI=1S/C21H30N7O8PS/c22-18-15-19(24-8-23-18)28(9-25-15)20-17(31)16(30)12(36-20)5-35-37(33,34)6-10(29)3-1-2-4-13-14-11(7-38-13)26-21(32)27-14/h8-9,11-14,16-17,20,30-31H,1-7H2,(H,33,34)(H2,22,23,24)(H2,26,27,32)/p-1/t11-,12+,13-,14-,16+,17+,20+/m0/s1 | Reactome pathway KEGG
UniProtKB/SwissProt
DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Patents
Similars
| Article PubMed
| n/a | n/a | 3.97E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Nebraska-Lincoln
Curated by ChEMBL
| Assay Description Inhibition of human recombinant HLCS using P67 as substrate after 2 hrs relative to vehicle-treated control |
Bioorg Med Chem Lett 24: 5568-71 (2014)
Article DOI: 10.1016/j.bmcl.2014.11.010 BindingDB Entry DOI: 10.7270/Q2W097KM |
More data for this Ligand-Target Pair | |
Biotin--protein ligase
(Homo sapiens (Human)) | BDBM50039494
(CHEMBL3357334)Show SMILES [NH4+].[H][C@]12CS[C@@H](CCCCC(O)CP([O-])(=O)OC[C@H]3O[C@H]([C@H](O)[C@@H]3O)n3cnc4c(N)ncnc34)[C@@]1([H])NC(=O)N2 |r| Show InChI InChI=1S/C21H32N7O8PS/c22-18-15-19(24-8-23-18)28(9-25-15)20-17(31)16(30)12(36-20)5-35-37(33,34)6-10(29)3-1-2-4-13-14-11(7-38-13)26-21(32)27-14/h8-14,16-17,20,29-31H,1-7H2,(H,33,34)(H2,22,23,24)(H2,26,27,32)/p-1/t10?,11-,12+,13-,14-,16+,17+,20+/m0/s1 | Reactome pathway KEGG
UniProtKB/SwissProt
DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Patents
Similars
| Article PubMed
| n/a | n/a | 2.04E+5 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Nebraska-Lincoln
Curated by ChEMBL
| Assay Description Inhibition of human recombinant HLCS using P67 as substrate after 2 hrs relative to vehicle-treated control |
Bioorg Med Chem Lett 24: 5568-71 (2014)
Article DOI: 10.1016/j.bmcl.2014.11.010 BindingDB Entry DOI: 10.7270/Q2W097KM |
More data for this Ligand-Target Pair | |