Found 634 hits with Last Name = 'inaba' and Initial = 'y' 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 |
Vitamin D3 receptor
(Homo sapiens (Human)) | BDBM50388528
(CHEMBL2058272)Show SMILES [#6]-[#6]C([#8])([#6]-[#6])[#6]-[#6]-[#6@@H](-[#6])-[#6@H]1-[#6]-[#6]-[#6@H]2\[#6](-[#6]-[#6]-[#6][C@]12[#6])=[#6]\[#6]=[#6]-1\[#6]-[#6@@H](-[#8])-[#6](=[#6])-[#6@H](-[#8])-[#6]-1 |r| Show InChI InChI=1S/C28H46O3/c1-6-28(31,7-2)16-14-19(3)23-12-13-24-22(9-8-15-27(23,24)5)11-10-21-17-25(29)20(4)26(30)18-21/h10-11,19,23-26,29-31H,4,6-9,12-18H2,1-3,5H3/b22-11+/t19-,23-,24+,25-,26-,27-/m1/s1 | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid PDB UniChem
Similars
| Article PubMed
| n/a | n/a | 0.0290 | n/a | n/a | n/a | n/a | n/a | n/a |
Showa Pharmaceutical University
Curated by ChEMBL
| Assay Description Displacement of [3H]1alpha,25-dihydroxyvitamin D3 from human recombinant GST-tagged vitamin D3 receptor LBD expressed in Escherichia coli BL21 after ... |
J Med Chem 55: 4373-81 (2012)
Article DOI: 10.1021/jm300230a BindingDB Entry DOI: 10.7270/Q25M66R0 |
More data for this Ligand-Target Pair | |
Vitamin D3 receptor
(Homo sapiens (Human)) | BDBM50200182
((1S,3R,5Z,7E)-9,10-secocholesta-5,7,10(19)-triene-...)Show SMILES C[C@H](CCCC(C)(C)O)[C@H]1CC[C@H]2\C(CCC[C@]12C)=C\C=C1\C[C@@H](O)C[C@H](O)C1=C |r| Show InChI InChI=1S/C27H44O3/c1-18(8-6-14-26(3,4)30)23-12-13-24-20(9-7-15-27(23,24)5)10-11-21-16-22(28)17-25(29)19(21)2/h10-11,18,22-25,28-30H,2,6-9,12-17H2,1,3-5H3/b20-10+,21-11-/t18-,22-,23-,24+,25+,27-/m1/s1 | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| Purchase
CHEMBL DrugBank MCE KEGG MMDB PC cid PC sid PDB UniChem
Patents
Similars
| DrugBank Article PubMed
| n/a | n/a | 0.0600 | n/a | n/a | n/a | n/a | n/a | n/a |
Showa Pharmaceutical University
Curated by ChEMBL
| Assay Description Displacement of [3H]-1alpha,25-dihydroxyvitamin D3 from recombinant human VDR LBD expressed in Escherichia coli BL21 (DE3) pLysS after 16 hrs |
Bioorg Med Chem 23: 7274-81 (2015)
Article DOI: 10.1016/j.bmc.2015.10.026 BindingDB Entry DOI: 10.7270/Q2R78H20 |
More data for this Ligand-Target Pair | |
Sepiapterin reductase
(Homo sapiens (Human)) | BDBM659822
(N-Cyclopropyl-7-hydroxy-4-isobutyl-5-oxo-3-((pyrid...)Show SMILES CC(C)Cn1c2c(COc3cccnc3)cnn2c(O)c(C(=O)NC2CC2)c1=O | PDB
UniProtKB/SwissProt
GoogleScholar AffyNet
| UniChem
| | n/a | n/a | 0.180 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this Ligand-Target Pair | |
Vitamin D3 receptor
(Homo sapiens (Human)) | BDBM50129805
(CHEMBL3629552)Show SMILES [H][C@@]1([#6]-[#6][C@@]2([H])\[#6](-[#6]-[#6]-[#6][C@]12[#6])=[#6]\[#6]=[#6]-1\[#6]-[#6@@H](-[#8])-[#6](=[#6])-[#6@H](-[#8])-[#6]-1)[#6@H](-[#6])-[#6@H](-[#6]-[#6]-[#8])-[#6]-[#6]-[#6]-[#6]-[#6]-[#6] |r| Show InChI InChI=1S/C30H50O3/c1-5-6-7-8-10-24(16-18-31)21(2)26-14-15-27-25(11-9-17-30(26,27)4)13-12-23-19-28(32)22(3)29(33)20-23/h12-13,21,24,26-29,31-33H,3,5-11,14-20H2,1-2,4H3/b25-13+/t21-,24+,26-,27+,28-,29-,30-/m1/s1 | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid PDB UniChem
Similars
| Article PubMed
| n/a | n/a | 0.210 | n/a | n/a | n/a | n/a | n/a | n/a |
Showa Pharmaceutical University
Curated by ChEMBL
| Assay Description Displacement of [3H]-1alpha,25-dihydroxyvitamin D3 from recombinant human VDR LBD expressed in Escherichia coli BL21 (DE3) pLysS after 16 hrs |
Bioorg Med Chem 23: 7274-81 (2015)
Article DOI: 10.1016/j.bmc.2015.10.026 BindingDB Entry DOI: 10.7270/Q2R78H20 |
More data for this Ligand-Target Pair | |
Vitamin D3 receptor
(Homo sapiens (Human)) | BDBM50388529
(CHEMBL2058273)Show SMILES [#6]-[#6]-[#6@@H](-[#6]C([#8])([#6]-[#6])[#6]-[#6])-[#6@@H](-[#6])-[#6@H]1-[#6]-[#6]-[#6@H]2\[#6](-[#6]-[#6]-[#6][C@]12[#6])=[#6]\[#6]=[#6]-1\[#6]-[#6@@H](-[#8])-[#6](=[#6])-[#6@H](-[#8])-[#6]-1 |r| Show InChI InChI=1S/C30H50O3/c1-7-23(19-30(33,8-2)9-3)20(4)25-14-15-26-24(11-10-16-29(25,26)6)13-12-22-17-27(31)21(5)28(32)18-22/h12-13,20,23,25-28,31-33H,5,7-11,14-19H2,1-4,6H3/b24-13+/t20-,23+,25-,26+,27-,28-,29-/m1/s1 | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 0.380 | n/a | n/a | n/a | n/a | n/a | n/a |
Showa Pharmaceutical University
Curated by ChEMBL
| Assay Description Displacement of [3H]1alpha,25-dihydroxyvitamin D3 from human recombinant GST-tagged vitamin D3 receptor LBD expressed in Escherichia coli BL21 after ... |
J Med Chem 55: 4373-81 (2012)
Article DOI: 10.1021/jm300230a BindingDB Entry DOI: 10.7270/Q25M66R0 |
More data for this Ligand-Target Pair | |
Sepiapterin reductase
(Homo sapiens (Human)) | BDBM659957
(N-Cyclopropyl-4-hydroxy-1-neopentyl-2,8-dioxo-1,2,...)Show SMILES CC(C)(C)Cn1c2c3ccc(=O)[nH]c3nn2c(O)c(C(=O)NC2CC2)c1=O | PDB
UniProtKB/SwissProt
GoogleScholar AffyNet
| UniChem
| | n/a | n/a | 0.390 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this Ligand-Target Pair | |
Vitamin D3 receptor
(Homo sapiens (Human)) | BDBM50388530
(CHEMBL2058274)Show SMILES [#6]-[#6]-[#6]-[#6]-[#6@@H](-[#6]C([#8])([#6]-[#6])[#6]-[#6])-[#6@@H](-[#6])-[#6@H]1-[#6]-[#6]-[#6@H]2\[#6](-[#6]-[#6]-[#6][C@]12[#6])=[#6]\[#6]=[#6]-1\[#6]-[#6@@H](-[#8])-[#6](=[#6])-[#6@H](-[#8])-[#6]-1 |r| Show InChI InChI=1S/C32H54O3/c1-7-10-12-26(21-32(35,8-2)9-3)22(4)27-16-17-28-25(13-11-18-31(27,28)6)15-14-24-19-29(33)23(5)30(34)20-24/h14-15,22,26-30,33-35H,5,7-13,16-21H2,1-4,6H3/b25-15+/t22-,26+,27-,28+,29-,30-,31-/m1/s1 | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid PDB UniChem
Similars
| Article PubMed
| n/a | n/a | 0.410 | n/a | n/a | n/a | n/a | n/a | n/a |
Showa Pharmaceutical University
Curated by ChEMBL
| Assay Description Displacement of [3H]1alpha,25-dihydroxyvitamin D3 from human recombinant GST-tagged vitamin D3 receptor LBD expressed in Escherichia coli BL21 after ... |
J Med Chem 55: 4373-81 (2012)
Article DOI: 10.1021/jm300230a BindingDB Entry DOI: 10.7270/Q25M66R0 |
More data for this Ligand-Target Pair | |
Sepiapterin reductase
(Homo sapiens (Human)) | BDBM660316
(3-((E)-3-((1S,4S)-2-Oxa-5-azabicyclo[2.2.1]heptan-...)Show SMILES CC(C)Cn1c2c(\C=C\C(=O)N3C[C@@H]4C[C@H]3CO4)c(C)nn2c(O)c(C(=O)NC2CC2)c1=O | PDB
UniProtKB/SwissProt
GoogleScholar AffyNet
| UniChem
| | n/a | n/a | 0.480 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this Ligand-Target Pair | |
Sepiapterin reductase
(Homo sapiens (Human)) | BDBM659933
((R,E)-N-Cyclopropyl-7-hydroxy-4-((1-methylcyclopro...)Show SMILES C[C@@H]1COCCN1C(=O)\C=C\c1cnn2c(O)c(C(=O)NC3CC3)c(=O)n(CC3(C)CC3)c12 | PDB
UniProtKB/SwissProt
GoogleScholar AffyNet
| UniChem
| | n/a | n/a | 0.540 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this Ligand-Target Pair | |
Sepiapterin reductase
(Homo sapiens (Human)) | BDBM659935
((R,E)-N-Cyclopropyl-7-hydroxy-3-(3-(3-(methoxymeth...)Show SMILES COC[C@@H]1COCCN1C(=O)\C=C\c1cnn2c(O)c(C(=O)NC3CC3)c(=O)n(CC3(C)CC3)c12 | PDB
UniProtKB/SwissProt
GoogleScholar AffyNet
| UniChem
| | n/a | n/a | 0.550 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
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More data for this Ligand-Target Pair | |
Sepiapterin reductase
(Homo sapiens (Human)) | BDBM660095
((R,E)-N-Cyclopropyl-7-hydroxy-4-isobutyl-3-(3-(3-(...)Show SMILES COC[C@@H]1COCCN1C(=O)\C=C\c1cnn2c(O)c(C(=O)NC3CC3)c(=O)n(CC(C)C)c12 | PDB
UniProtKB/SwissProt
GoogleScholar AffyNet
| UniChem
| | n/a | n/a | 0.550 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this Ligand-Target Pair | |
Sepiapterin reductase
(Homo sapiens (Human)) | BDBM659964
(N-Cyclopropyl-9-hydroxy-6-neopentyl-2,7-dioxo-1,2,...)Show SMILES CC(C)(C)Cn1c2c3CCOC(=O)Nc3nn2c(O)c(C(=O)NC2CC2)c1=O | PDB
UniProtKB/SwissProt
GoogleScholar AffyNet
| UniChem
| | n/a | n/a | 0.560 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this Ligand-Target Pair | |
Sepiapterin reductase
(Homo sapiens (Human)) | BDBM660080
((E)-N-Cyclopropyl-7-hydroxy-4-isobutyl-3-(3-((2-me...)Show SMILES COCCNC(=O)\C=C\c1cnn2c(O)c(C(=O)NC3CC3)c(=O)n(CC(C)C)c12 | PDB
UniProtKB/SwissProt
GoogleScholar AffyNet
| UniChem
| | n/a | n/a | 0.570 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this Ligand-Target Pair | |
Sepiapterin reductase
(Homo sapiens (Human)) | BDBM659932
((S,E)-N-Cyclopropyl-7-hydroxy-4-((1-methylcyclopro...)Show SMILES C[C@H]1COCCN1C(=O)\C=C\c1cnn2c(O)c(C(=O)NC3CC3)c(=O)n(CC3(C)CC3)c12 | PDB
UniProtKB/SwissProt
GoogleScholar AffyNet
| UniChem
| | n/a | n/a | 0.580 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
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More data for this Ligand-Target Pair | |
Sepiapterin reductase
(Homo sapiens (Human)) | BDBM660019
((E)-3-(3-(8-Oxa-3-azabicyclo[3.2.1]octan-3-yl)-3-o...)Show SMILES CC(C)Cn1c2c(\C=C\C(=O)N3CC4CCC(C3)O4)cnn2c(O)c(C(=O)NC2CC2)c1=O | PDB
UniProtKB/SwissProt
GoogleScholar AffyNet
| UniChem
| | n/a | n/a | 0.580 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
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More data for this Ligand-Target Pair | |
Sepiapterin reductase
(Homo sapiens (Human)) | BDBM660077
((E)-N-Cyclopropyl-3-(3-(1,1-dioxidothiomorpholino)...)Show SMILES CC(C)Cn1c2c(\C=C\C(=O)N3CCS(=O)(=O)CC3)cnn2c(O)c(C(=O)NC2CC2)c1=O | PDB
UniProtKB/SwissProt
GoogleScholar AffyNet
| UniChem
| | n/a | n/a | 0.580 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
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More data for this Ligand-Target Pair | |
Sepiapterin reductase
(Homo sapiens (Human)) | BDBM659979
((E)-2-Amino-N-cyclopropyl-7-hydroxy-4-isobutyl-3-(...)Show SMILES CC(C)Cn1c2c(\C=C\C(=O)N3CCOCC3)c(N)nn2c(O)c(C(=O)NC2CC2)c1=O | PDB
UniProtKB/SwissProt
GoogleScholar AffyNet
| UniChem
| | n/a | n/a | 0.590 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
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More data for this Ligand-Target Pair | |
Sepiapterin reductase
(Homo sapiens (Human)) | BDBM659980
((S,E)-2-Amino-N-cyclopropyl-7-hydroxy-4-isobutyl-3...)Show SMILES CC(C)Cn1c2c(\C=C\C(=O)N3CCOC[C@@H]3C)c(N)nn2c(O)c(C(=O)NC2CC2)c1=O | PDB
UniProtKB/SwissProt
GoogleScholar AffyNet
| UniChem
| | n/a | n/a | 0.590 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
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More data for this Ligand-Target Pair | |
Sepiapterin reductase
(Homo sapiens (Human)) | BDBM660060
((E)-N-Cyclopropyl-3-(3-(cyclopropyl(methyl)amino)-...)Show SMILES CC(C)Cn1c2c(\C=C\C(=O)N(C)C3CC3)cnn2c(O)c(C(=O)NC2CC2)c1=O | PDB
UniProtKB/SwissProt
GoogleScholar AffyNet
| UniChem
| | n/a | n/a | 0.590 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
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More data for this Ligand-Target Pair | |
Sepiapterin reductase
(Homo sapiens (Human)) | BDBM660084
((S,E)-N-Cyclopropyl-7-hydroxy-3-(3-(2-(hydroxymeth...)Show SMILES CC(C)Cn1c2c(\C=C\C(=O)N3CCO[C@H](CO)C3)cnn2c(O)c(C(=O)NC2CC2)c1=O | PDB
UniProtKB/SwissProt
GoogleScholar AffyNet
| UniChem
| | n/a | n/a | 0.590 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
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More data for this Ligand-Target Pair | |
Sepiapterin reductase
(Homo sapiens (Human)) | BDBM659949
((E)-N-Cyclopropyl-7-hydroxy-4-((4-methyltetrahydro...)Show SMILES CC1(Cn2c3c(\C=C\C(=O)N4CCOCC4)cnn3c(O)c(C(=O)NC3CC3)c2=O)CCOCC1 | PDB
UniProtKB/SwissProt
GoogleScholar AffyNet
| UniChem
| | n/a | n/a | 0.600 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
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More data for this Ligand-Target Pair | |
Sepiapterin reductase
(Homo sapiens (Human)) | BDBM660013
((E)-N6-Cyclopropyl-7-hydroxy-4-isobutyl-3-(3-morph...)Show SMILES CC(C)Cn1c2c(\C=C\C(=O)N3CCOCC3)c(nn2c(O)c(C(=O)NC2CC2)c1=O)C(N)=O | PDB
UniProtKB/SwissProt
GoogleScholar AffyNet
| UniChem
| | n/a | n/a | 0.600 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
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More data for this Ligand-Target Pair | |
Sepiapterin reductase
(Homo sapiens (Human)) | BDBM659931
((E)-3-(3-(8-Oxa-3-azabicyclo[3.2.1]octan-3-yl)-3-o...)Show SMILES CC1(Cn2c3c(\C=C\C(=O)N4CC5CCC(C4)O5)cnn3c(O)c(C(=O)NC3CC3)c2=O)CC1 | PDB
UniProtKB/SwissProt
GoogleScholar AffyNet
| UniChem
| | n/a | n/a | 0.610 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
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More data for this Ligand-Target Pair | |
Sepiapterin reductase
(Homo sapiens (Human)) | BDBM659934
((S,E)-N-Cyclopropyl-7-hydroxy-3-(3-(3-(methoxymeth...)Show SMILES COC[C@H]1COCCN1C(=O)\C=C\c1cnn2c(O)c(C(=O)NC3CC3)c(=O)n(CC3(C)CC3)c12 | PDB
UniProtKB/SwissProt
GoogleScholar AffyNet
| UniChem
| | n/a | n/a | 0.610 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
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More data for this Ligand-Target Pair | |
Sepiapterin reductase
(Homo sapiens (Human)) | BDBM659966
(N-Cyclopropyl-4-hydroxy-1-neopentyl-2,8-dioxo-1,2,...)Show SMILES CC(C)(C)Cn1c2c3CCC(=O)Nc3nn2c(O)c(C(=O)NC2CC2)c1=O | PDB
UniProtKB/SwissProt
GoogleScholar AffyNet
| UniChem
| | n/a | n/a | 0.610 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
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More data for this Ligand-Target Pair | |
Sepiapterin reductase
(Homo sapiens (Human)) | BDBM659981
((R,E)-2-Amino-N-cyclopropyl-7-hydroxy-4-isobutyl-3...)Show SMILES CC(C)Cn1c2c(\C=C\C(=O)N3CCOC[C@H]3C)c(N)nn2c(O)c(C(=O)NC2CC2)c1=O | PDB
UniProtKB/SwissProt
GoogleScholar AffyNet
| UniChem
| | n/a | n/a | 0.610 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
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More data for this Ligand-Target Pair | |
Sepiapterin reductase
(Homo sapiens (Human)) | BDBM660079
((E)-N-Cyclopropyl-7-hydroxy-4-isobutyl-5-oxo-3-(3-...)Show SMILES CC(C)Cn1c2c(\C=C\C(=O)N3CCC(=O)C3)cnn2c(O)c(C(=O)NC2CC2)c1=O | PDB
UniProtKB/SwissProt
GoogleScholar AffyNet
| UniChem
| | n/a | n/a | 0.610 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
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More data for this Ligand-Target Pair | |
Sepiapterin reductase
(Homo sapiens (Human)) | BDBM660318
(N-Cyclopropyl-3-((E)-3-(trans-3,4-difluoropyrrolid...)Show SMILES CC(C)Cn1c2c(\C=C\C(=O)N3C[C@H](F)[C@@H](F)C3)c(C)nn2c(O)c(C(=O)NC2CC2)c1=O | PDB
UniProtKB/SwissProt
GoogleScholar AffyNet
| UniChem
| | n/a | n/a | 0.610 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
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More data for this Ligand-Target Pair | |
Sepiapterin reductase
(Homo sapiens (Human)) | BDBM659930
((E)-3-(3-(3-Oxa-8-azabicyclo[3.2.1]octan-8-yl)-3-o...)Show SMILES CC1(Cn2c3c(\C=C\C(=O)N4C5CCC4COC5)cnn3c(O)c(C(=O)NC3CC3)c2=O)CC1 |THB:8:10:15.16.17:12.13| | PDB
UniProtKB/SwissProt
GoogleScholar AffyNet
| UniChem
| | n/a | n/a | 0.620 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
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More data for this Ligand-Target Pair | |
Sepiapterin reductase
(Homo sapiens (Human)) | BDBM660119
(N-Cyclopropyl-3-((E)-3-((3R,5R)-3,5-dimethylmorpho...)Show SMILES CC(C)Cn1c2c(\C=C\C(=O)N3[C@H](C)COC[C@H]3C)cnn2c(O)c(C(=O)NC2CC2)c1=O | PDB
UniProtKB/SwissProt
GoogleScholar AffyNet
| UniChem
| | n/a | n/a | 0.620 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
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More data for this Ligand-Target Pair | |
Sepiapterin reductase
(Homo sapiens (Human)) | BDBM659927
((E)-N-Cyclopropyl-4-((1-fluorocyclopropyl)methyl)-...)Show SMILES Oc1c(C(=O)NC2CC2)c(=O)n(CC2(F)CC2)c2c(\C=C\C(=O)N3CCOCC3)cnn12 | PDB
UniProtKB/SwissProt
GoogleScholar AffyNet
| UniChem
| | n/a | n/a | 0.630 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
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Citation and Details
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More data for this Ligand-Target Pair | |
Sepiapterin reductase
(Homo sapiens (Human)) | BDBM659965
(N-Cyclopropyl-7-hydroxy-4-neopentyl-2,5-dioxo-2,3,...)Show SMILES CC(C)(C)Cn1c2c3CC(=O)Nc3nn2c(O)c(C(=O)NC2CC2)c1=O | PDB
UniProtKB/SwissProt
GoogleScholar AffyNet
| UniChem
| | n/a | n/a | 0.630 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
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More data for this Ligand-Target Pair | |
Sepiapterin reductase
(Homo sapiens (Human)) | BDBM659967
(N-Cyclopropyl-4-hydroxy-1-isobutyl-2,8-dioxo-1,2,7...)Show SMILES CC(C)Cn1c2c3CCC(=O)Nc3nn2c(O)c(C(=O)NC2CC2)c1=O | PDB
UniProtKB/SwissProt
GoogleScholar AffyNet
| UniChem
| | n/a | n/a | 0.630 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
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More data for this Ligand-Target Pair | |
Sepiapterin reductase
(Homo sapiens (Human)) | BDBM660145
((E)-N-Cyclopropyl-7-hydroxy-2-methyl-3-(3-morpholi...)Show SMILES Cc1nn2c(O)c(C(=O)NC3CC3)c(=O)n(CC(C)(C)C)c2c1\C=C\C(=O)N1CCOCC1 | PDB
UniProtKB/SwissProt
GoogleScholar AffyNet
| UniChem
| | n/a | n/a | 0.630 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
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More data for this Ligand-Target Pair | |
Sepiapterin reductase
(Homo sapiens (Human)) | BDBM659784
(N6-Cyclopropyl-7-hydroxy-4-isobutyl-5-oxo-N3-((tet...)Show SMILES CC(C)Cn1c2c(cnn2c(O)c(C(=O)NC2CC2)c1=O)C(=O)NCC1CCOCC1 | PDB
UniProtKB/SwissProt
GoogleScholar AffyNet
| UniChem
| | n/a | n/a | 0.640 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
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Citation and Details
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More data for this Ligand-Target Pair | |
Sepiapterin reductase
(Homo sapiens (Human)) | BDBM660040
((E)-3-(3-(4-Carbamoylpiperidin-1-yl)-3-oxoprop-1-e...)Show SMILES CC(C)Cn1c2c(\C=C\C(=O)N3CCC(CC3)C(N)=O)cnn2c(O)c(C(=O)NC2CC2)c1=O | PDB
UniProtKB/SwissProt
GoogleScholar AffyNet
| UniChem
| | n/a | n/a | 0.640 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
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Citation and Details
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More data for this Ligand-Target Pair | |
Sepiapterin reductase
(Homo sapiens (Human)) | BDBM660096
((E)-3-(3-(3-Oxa-8-azabicyclo[3.2.1]octan-8-yl)-3-o...)Show SMILES CC(C)Cn1c2c(\C=C\C(=O)N3C4CCC3COC4)cnn2c(O)c(C(=O)NC2CC2)c1=O |THB:9:11:16.17.18:13.14| | PDB
UniProtKB/SwissProt
GoogleScholar AffyNet
| UniChem
| | n/a | n/a | 0.640 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
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Citation and Details
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More data for this Ligand-Target Pair | |
Sepiapterin reductase
(Homo sapiens (Human)) | BDBM660102
(3-((E)-3-((1S,4S)-2-Oxa-5-azabicyclo[2.2.1]heptan-...)Show SMILES CC(C)Cn1c2c(\C=C\C(=O)N3C[C@@H]4C[C@H]3CO4)cnn2c(O)c(C(=O)NC2CC2)c1=O | PDB
UniProtKB/SwissProt
GoogleScholar AffyNet
| UniChem
| | n/a | n/a | 0.640 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
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Citation and Details
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More data for this Ligand-Target Pair | |
Sepiapterin reductase
(Homo sapiens (Human)) | BDBM660244
((E)-3-(3-((Cyanomethyl)(methyl)amino)-3-oxoprop-1-...)Show SMILES CC(C)Cn1c2c(\C=C\C(=O)N(C)CC#N)c(C)nn2c(O)c(C(=O)NC2CC2)c1=O | PDB
UniProtKB/SwissProt
GoogleScholar AffyNet
| UniChem
| | n/a | n/a | 0.640 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
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More data for this Ligand-Target Pair | |
Sepiapterin reductase
(Homo sapiens (Human)) | BDBM659771
(N6-Cyclopropyl-7-hydroxy-4-neopentyl-5-oxo-4,5-dih...)Show SMILES CC(C)(C)Cn1c2cc(nn2c(O)c(C(=O)NC2CC2)c1=O)C(N)=O | PDB
UniProtKB/SwissProt
GoogleScholar AffyNet
| UniChem
| | n/a | n/a | 0.650 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
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More data for this Ligand-Target Pair | |
Sepiapterin reductase
(Homo sapiens (Human)) | BDBM659790
(N-Cyclopropyl-7-hydroxy-4-isobutyl-3-(morpholine-4...)Show SMILES CC(C)Cn1c2c(cnn2c(O)c(C(=O)NC2CC2)c1=O)C(=O)N1CCOCC1 | PDB
UniProtKB/SwissProt
GoogleScholar AffyNet
| UniChem
| | n/a | n/a | 0.650 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
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More data for this Ligand-Target Pair | |
Sepiapterin reductase
(Homo sapiens (Human)) | BDBM659794
(N6-Cyclopropyl-7-hydroxy-4-isobutyl-5-oxo-N3-(pyri...)Show SMILES CC(C)Cn1c2c(cnn2c(O)c(C(=O)NC2CC2)c1=O)C(=O)NCc1ncccn1 | PDB
UniProtKB/SwissProt
GoogleScholar AffyNet
| UniChem
| | n/a | n/a | 0.650 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
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More data for this Ligand-Target Pair | |
Sepiapterin reductase
(Homo sapiens (Human)) | BDBM659928
((E)-N-Cyclopropyl-7-hydroxy-4-(2-methoxy-2-methylp...)Show SMILES COC(C)(C)Cn1c2c(\C=C\C(=O)N3CCOCC3)cnn2c(O)c(C(=O)NC2CC2)c1=O | PDB
UniProtKB/SwissProt
GoogleScholar AffyNet
| UniChem
| | n/a | n/a | 0.650 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
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More data for this Ligand-Target Pair | |
Sepiapterin reductase
(Homo sapiens (Human)) | BDBM659937
(3-((E)-3-((1S,4S)-2-Oxa-5-azabicyclo[2.2.1]heptan-...)Show SMILES CC1(Cn2c3c(\C=C\C(=O)N4C[C@H]5C[C@@H]4CO5)cnn3c(O)c(C(=O)NC3CC3)c2=O)CC1 | PDB
UniProtKB/SwissProt
GoogleScholar AffyNet
| UniChem
| | n/a | n/a | 0.650 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
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More data for this Ligand-Target Pair | |
Sepiapterin reductase
(Homo sapiens (Human)) | BDBM659938
(3-((E)-3-((1S,4S)-2-Oxa-5-azabicyclo[2.2.1]heptan-...)Show SMILES Oc1c(C(=O)NC2CC2)c(=O)n(CC2(F)CC2)c2c(\C=C\C(=O)N3C[C@H]4C[C@@H]3CO4)cnn12 | PDB
UniProtKB/SwissProt
GoogleScholar AffyNet
| UniChem
| | n/a | n/a | 0.650 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
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More data for this Ligand-Target Pair | |
Sepiapterin reductase
(Homo sapiens (Human)) | BDBM659974
((E)-2-Amino-N-cyclopropyl-7-hydroxy-3-(3-morpholin...)Show SMILES CC(C)(C)Cn1c2c(\C=C\C(=O)N3CCOCC3)c(N)nn2c(O)c(C(=O)NC2CC2)c1=O | PDB
UniProtKB/SwissProt
GoogleScholar AffyNet
| UniChem
| | n/a | n/a | 0.650 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
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Citation and Details
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More data for this Ligand-Target Pair | |
Sepiapterin reductase
(Homo sapiens (Human)) | BDBM660006
((E)-2-Amino-N-cyclopropyl-7-hydroxy-5-oxo-4-((tetr...)Show SMILES Nc1nn2c(O)c(C(=O)NC3CC3)c(=O)n(CC3CCOCC3)c2c1\C=C\C1CCOCC1 | PDB
UniProtKB/SwissProt
GoogleScholar AffyNet
| UniChem
| | n/a | n/a | 0.650 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
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Citation and Details
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More data for this Ligand-Target Pair | |
Sepiapterin reductase
(Homo sapiens (Human)) | BDBM660088
((S,E)-N-Cyclopropyl-7-hydroxy-3-(3-(3-(hydroxymeth...)Show SMILES CC(C)Cn1c2c(\C=C\C(=O)N3CCOC[C@@H]3CO)cnn2c(O)c(C(=O)NC2CC2)c1=O | PDB
UniProtKB/SwissProt
GoogleScholar AffyNet
| UniChem
| | n/a | n/a | 0.650 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
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More data for this Ligand-Target Pair | |
Sepiapterin reductase
(Homo sapiens (Human)) | BDBM659995
(N-Cyclopropyl-3-((E)-3-((3S,5S)-3,5-dimethylmorpho...)Show SMILES CNc1nn2c(O)c(C(=O)NC3CC3)c(=O)n(CC(C)C)c2c1\C=C\C(=O)N1[C@@H](C)COC[C@@H]1C | PDB
UniProtKB/SwissProt
GoogleScholar AffyNet
| UniChem
| | n/a | n/a | 0.660 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
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More data for this Ligand-Target Pair | |
Sepiapterin reductase
(Homo sapiens (Human)) | BDBM660008
((E)-2-Amino-N-cyclopropyl-7-hydroxy-4-((4-methylte...)Show SMILES CC1(Cn2c3c(\C=C\C4CCOCC4)c(N)nn3c(O)c(C(=O)NC3CC3)c2=O)CCOCC1 | PDB
UniProtKB/SwissProt
GoogleScholar AffyNet
| UniChem
| | n/a | n/a | 0.660 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
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More data for this Ligand-Target Pair | |