Target/Host (Institution) | Ligand | Target/Host Links | Ligand Links | Trg + Lig Links | Ki nM | ΔG° kcal/mole | IC50 nM | Kd nM | EC50/IC50 nM | koff s-1 | kon M-1s-1 | pH | Temp °C |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
17-beta-Hydroxysteroid Dehydrogenase 5 (17-beta-HSD5, AKR1C3) (Homo sapiens (human)) | BDBM50427622![]() (CHEMBL2323508 | US9346803, Table 2, Compound 10: 3...) | PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet ![]() | CHEMBL PC cid PC sid UniChem Similars | n/a | n/a | 0.0900 | n/a | n/a | n/a | n/a | n/a | n/a | |
Vanderbilt University; The Trustees of the University of Pennsylvania US Patent | Assay Description Inhibitors were initially screened for an ability to block the NADP+ dependent oxidation of the artificial substrate S-tetralol catalyzed by AKR1C3. ... | US Patent US9346803 (2016) BindingDB Entry DOI: 10.7270/Q2154FXN | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
17-beta-Hydroxysteroid Dehydrogenase 5 (17-beta-HSD5, AKR1C3) (Homo sapiens (human)) | BDBM50427628![]() (CHEMBL2323472 | US9346803, Table 2, Compound 8: 2-...) | PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet ![]() | CHEMBL PC cid PC sid UniChem Similars | n/a | n/a | 0.120 | n/a | n/a | n/a | n/a | n/a | n/a | |
Vanderbilt University; The Trustees of the University of Pennsylvania US Patent | Assay Description Inhibitors were initially screened for an ability to block the NADP+ dependent oxidation of the artificial substrate S-tetralol catalyzed by AKR1C3. ... | US Patent US9346803 (2016) BindingDB Entry DOI: 10.7270/Q2154FXN | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
17-beta-Hydroxysteroid Dehydrogenase 5 (17-beta-HSD5, AKR1C3) (Homo sapiens (human)) | BDBM50427620![]() (CHEMBL2323507 | US9346803, 2) | PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet ![]() | CHEMBL PC cid PC sid UniChem Similars | n/a | n/a | 0.130 | n/a | n/a | n/a | n/a | n/a | n/a | |
Vanderbilt University; The Trustees of the University of Pennsylvania US Patent | Assay Description Inhibitors were initially screened for an ability to block the NADP+ dependent oxidation of the artificial substrate S-tetralol catalyzed by AKR1C3. ... | US Patent US9346803 (2016) BindingDB Entry DOI: 10.7270/Q2154FXN | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
17-beta-Hydroxysteroid Dehydrogenase 5 (17-beta-HSD5, AKR1C3) (Homo sapiens (human)) | BDBM50427624![]() (CHEMBL2323522 | US9346803, Table 2, Compound 11: 9...) | PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet ![]() | CHEMBL PC cid PC sid UniChem Similars | n/a | n/a | 0.160 | n/a | n/a | n/a | n/a | n/a | n/a | |
Vanderbilt University; The Trustees of the University of Pennsylvania US Patent | Assay Description Inhibitors were initially screened for an ability to block the NADP+ dependent oxidation of the artificial substrate S-tetralol catalyzed by AKR1C3. ... | US Patent US9346803 (2016) BindingDB Entry DOI: 10.7270/Q2154FXN | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
17-beta-Hydroxysteroid Dehydrogenase 5 (17-beta-HSD5, AKR1C3) (Homo sapiens (human)) | BDBM50427629![]() (CHEMBL179587 | US9346803, Table 2, Compound 7: 2-[...) | PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet ![]() | CHEMBL PC cid PC sid UniChem Similars | n/a | n/a | 0.160 | n/a | n/a | n/a | n/a | n/a | n/a | |
Vanderbilt University; The Trustees of the University of Pennsylvania US Patent | Assay Description Inhibitors were initially screened for an ability to block the NADP+ dependent oxidation of the artificial substrate S-tetralol catalyzed by AKR1C3. ... | US Patent US9346803 (2016) BindingDB Entry DOI: 10.7270/Q2154FXN | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
17-beta-Hydroxysteroid Dehydrogenase 5 (17-beta-HSD5, AKR1C3) (Homo sapiens (human)) | BDBM50427621![]() (CHEMBL2323490 | US9346803, 1) | PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet ![]() | CHEMBL PC cid PC sid UniChem Similars | n/a | n/a | 0.210 | n/a | n/a | n/a | n/a | n/a | n/a | |
Vanderbilt University; The Trustees of the University of Pennsylvania US Patent | Assay Description Inhibitors were initially screened for an ability to block the NADP+ dependent oxidation of the artificial substrate S-tetralol catalyzed by AKR1C3. ... | US Patent US9346803 (2016) BindingDB Entry DOI: 10.7270/Q2154FXN | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
17-beta-Hydroxysteroid Dehydrogenase 5 (17-beta-HSD5, AKR1C3) (Homo sapiens (human)) | BDBM50427625![]() (CHEMBL178687 | US9346803, Table 2, Compound 6: 3-[...) | PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet ![]() | CHEMBL PC cid PC sid UniChem Similars | n/a | n/a | 0.220 | n/a | n/a | n/a | n/a | n/a | n/a | |
Vanderbilt University; The Trustees of the University of Pennsylvania US Patent | Assay Description Inhibitors were initially screened for an ability to block the NADP+ dependent oxidation of the artificial substrate S-tetralol catalyzed by AKR1C3. ... | US Patent US9346803 (2016) BindingDB Entry DOI: 10.7270/Q2154FXN | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
17-beta-Hydroxysteroid Dehydrogenase 5 (17-beta-HSD5, AKR1C3) (Homo sapiens (human)) | BDBM50427627![]() (CHEMBL2323474 | US9346803, Table 2, Compound 9: 2-...) | PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet ![]() | CHEMBL PC cid PC sid UniChem Similars | n/a | n/a | 0.270 | n/a | n/a | n/a | n/a | n/a | n/a | |
Vanderbilt University; The Trustees of the University of Pennsylvania US Patent | Assay Description Inhibitors were initially screened for an ability to block the NADP+ dependent oxidation of the artificial substrate S-tetralol catalyzed by AKR1C3. ... | US Patent US9346803 (2016) BindingDB Entry DOI: 10.7270/Q2154FXN | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
17-beta-Hydroxysteroid Dehydrogenase 5 (17-beta-HSD5, AKR1C3) (Homo sapiens (human)) | BDBM50438582![]() (CHEMBL2413849) | PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet ![]() | CHEMBL PC cid PC sid UniChem Similars | Article PubMed | n/a | n/a | 0.340 | n/a | n/a | n/a | n/a | n/a | n/a |
Astellas Pharma Inc. Curated by ChEMBL | Assay Description Inhibition of human 17beta-HSD5 expressed in HEK293 cells using androstenedione as substrate assessed as testosterone synthesis after 4 hrs | Bioorg Med Chem 21: 5261-70 (2013) Article DOI: 10.1016/j.bmc.2013.06.025 BindingDB Entry DOI: 10.7270/Q2GF0VXW | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
17-beta-Hydroxysteroid Dehydrogenase 5 (17-beta-HSD5, AKR1C3) (Homo sapiens (human)) | BDBM50427619![]() (CHEMBL2323511 | US9346803, 3) | PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet ![]() | CHEMBL PC cid PC sid UniChem Similars | n/a | n/a | 0.340 | n/a | n/a | n/a | n/a | n/a | n/a | |
Vanderbilt University; The Trustees of the University of Pennsylvania US Patent | Assay Description Inhibitors were initially screened for an ability to block the NADP+ dependent oxidation of the artificial substrate S-tetralol catalyzed by AKR1C3. ... | US Patent US9346803 (2016) BindingDB Entry DOI: 10.7270/Q2154FXN | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
17-beta-Hydroxysteroid Dehydrogenase 5 (17-beta-HSD5, AKR1C3) (Homo sapiens (human)) | BDBM50427626![]() (CHEMBL2323481 | US9346803, Table 2, Compound 5: 2-...) | PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet ![]() | CHEMBL PC cid PC sid UniChem Similars | n/a | n/a | 0.740 | n/a | n/a | n/a | n/a | n/a | n/a | |
Vanderbilt University; The Trustees of the University of Pennsylvania US Patent | Assay Description Inhibitors were initially screened for an ability to block the NADP+ dependent oxidation of the artificial substrate S-tetralol catalyzed by AKR1C3. ... | US Patent US9346803 (2016) BindingDB Entry DOI: 10.7270/Q2154FXN | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
17-beta-Hydroxysteroid Dehydrogenase 5 (17-beta-HSD5, AKR1C3) (Homo sapiens (human)) | BDBM50293598![]() (2'-des-methyl indomethacin | CHEMBL503179 | US9346...) | PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet ![]() | CHEMBL MMDB PC cid PC sid PDB UniChem Patents Similars | PDB | n/a | n/a | 0.960 | n/a | n/a | n/a | n/a | n/a | n/a |
Vanderbilt University; The Trustees of the University of Pennsylvania US Patent | Assay Description Inhibitors were initially screened for an ability to block the NADP+ dependent oxidation of the artificial substrate S-tetralol catalyzed by AKR1C3. ... | US Patent US9346803 (2016) BindingDB Entry DOI: 10.7270/Q2154FXN | |||||||||||
More data for this Ligand-Target Pair | ![]() 3D Structure (crystal) | ||||||||||||
17-beta-Hydroxysteroid Dehydrogenase 5 (17-beta-HSD5, AKR1C3) (Homo sapiens (human)) | BDBM50438582![]() (CHEMBL2413849) | PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet ![]() | CHEMBL PC cid PC sid UniChem Similars | Article PubMed | n/a | n/a | 1.90 | n/a | n/a | n/a | n/a | n/a | n/a |
Astellas Pharma Inc. Curated by ChEMBL | Assay Description Inhibition of human 17beta-HSD5 expressed in human CWR22R cells using androstenedione as substrate assessed as testosterone synthesis after 4 hrs | Bioorg Med Chem 21: 5261-70 (2013) Article DOI: 10.1016/j.bmc.2013.06.025 BindingDB Entry DOI: 10.7270/Q2GF0VXW | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
17-beta-Hydroxysteroid Dehydrogenase 5 (17-beta-HSD5, AKR1C3) (Homo sapiens (human)) | BDBM50438585![]() (CHEMBL2413850) | PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet ![]() | CHEMBL PC cid PC sid UniChem Similars | Article PubMed | n/a | n/a | 2.10 | n/a | n/a | n/a | n/a | n/a | n/a |
Astellas Pharma Inc. Curated by ChEMBL | Assay Description Inhibition of human 17beta-HSD5 expressed in HEK293 cells using androstenedione as substrate assessed as testosterone synthesis after 4 hrs | Bioorg Med Chem 21: 5261-70 (2013) Article DOI: 10.1016/j.bmc.2013.06.025 BindingDB Entry DOI: 10.7270/Q2GF0VXW | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
17-beta-Hydroxysteroid Dehydrogenase 5 (17-beta-HSD5, AKR1C3) (Homo sapiens (human)) | BDBM50267369![]() ((2'R,8R,9S,13S,14S)-5',5',13-trimethyl-4',5',6,7,8...) | PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet ![]() | CHEMBL PC cid PC sid UniChem Similars | Article PubMed | n/a | n/a | 2.90 | n/a | n/a | n/a | n/a | n/a | n/a |
CHUL Research Center and University Laval Curated by ChEMBL | Assay Description Inhibition of human 17beta-HSD5 expressed in HEK293 cells assessed as enzyme-mediated transformation of [14C]-4-androstene-3,17-dione in to [14C]-tes... | Eur J Med Chem 44: 632-44 (2009) Article DOI: 10.1016/j.ejmech.2008.03.020 BindingDB Entry DOI: 10.7270/Q2K64HWB | |||||||||||
More data for this Ligand-Target Pair | ![]() 3D Structure (docked) | ||||||||||||
17-beta-Hydroxysteroid Dehydrogenase 5 (17-beta-HSD5, AKR1C3) (Homo sapiens (human)) | BDBM50446016![]() (CHEMBL3103330) | PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet ![]() | CHEMBL PC cid PC sid UniChem Similars | Article PubMed | n/a | n/a | 3 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Auckland Curated by ChEMBL | Assay Description Inhibition of AKR1C3 (unknown origin) expressed in human HCT116 cells assessed as formation of PR-104H from PR-104A preincubated for 2 hrs | Bioorg Med Chem 22: 967-77 (2014) Article DOI: 10.1016/j.bmc.2013.12.050 BindingDB Entry DOI: 10.7270/Q25H7HQM | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
17-beta-Hydroxysteroid Dehydrogenase 5 (17-beta-HSD5, AKR1C3) (Homo sapiens (human)) | BDBM17285![]() ((2R,15'S)-5,5,15'-trimethyl-6-oxospiro[oxane-2,14'...) | PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet ![]() | PC cid PC sid UniChem Patents Similars | Article PubMed | n/a | n/a | 3.20 | n/a | n/a | n/a | n/a | 6.0 | 22 |
CHUL | Assay Description SPA beads conjugated to anti-mouse IgG were incubated overnight in buffer with anti-testosterone monoclonal antibody. The enzymatic reaction was moni... | J Biol Chem 282: 8368-79 (2007) Article DOI: 10.1074/jbc.M606784200 BindingDB Entry DOI: 10.7270/Q27H1GVB | |||||||||||
More data for this Ligand-Target Pair | ![]() 3D Structure (docked) | ||||||||||||
Aldo-keto-reductase family 1 member C3 (Homo sapiens (human)) | BDBM264475![]() (17-oxooestra-1,3,5(10)-triene-3,11a-diyl diacetate...) | PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet ![]() | PC cid PC sid UniChem | n/a | n/a | 4 | n/a | n/a | n/a | n/a | n/a | n/a | |
BAYER PHARMA AKTIENGESELLSCHAFT US Patent | Assay Description For the assay, 50 nl of a 100-fold concentrated solution of the test substance in DMSO were pipetted into a black low-volume 384-well microtitre plat... | US Patent US9714266 (2017) | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Aldo-keto-reductase family 1 member C3 (Homo sapiens (human)) | BDBM264504![]() (N?[(S)-2,3-dihydroxypropyl]-17-(5-fluoropyridin-3-...) | PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet ![]() | PC cid PC sid UniChem | n/a | n/a | 4 | n/a | n/a | n/a | n/a | n/a | n/a | |
BAYER PHARMA AKTIENGESELLSCHAFT US Patent | Assay Description For the assay, 50 nl of a 100-fold concentrated solution of the test substance in DMSO were pipetted into a black low-volume 384-well microtitre plat... | US Patent US9714266 (2017) | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Aldo-keto-reductase family 1 member C3 (Homo sapiens (human)) | BDBM264509![]() (17-(5-fluoropyridin-3-yl)-N?[(R)-2-hydroxypropyl]o...) | PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet ![]() | PC cid PC sid UniChem | n/a | n/a | 4 | n/a | n/a | n/a | n/a | n/a | n/a | |
BAYER PHARMA AKTIENGESELLSCHAFT US Patent | Assay Description For the assay, 50 nl of a 100-fold concentrated solution of the test substance in DMSO were pipetted into a black low-volume 384-well microtitre plat... | US Patent US9714266 (2017) | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
17-beta-Hydroxysteroid Dehydrogenase 5 (17-beta-HSD5, AKR1C3) (Homo sapiens (human)) | BDBM50438594![]() (CHEMBL2413860) | PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet ![]() | CHEMBL PC cid PC sid UniChem Similars | Article PubMed | n/a | n/a | 4.5 | n/a | n/a | n/a | n/a | n/a | n/a |
Astellas Pharma Inc. Curated by ChEMBL | Assay Description Inhibition of human 17beta-HSD5 expressed in HEK293 cells using androstenedione as substrate assessed as testosterone synthesis after 4 hrs | Bioorg Med Chem 21: 5261-70 (2013) Article DOI: 10.1016/j.bmc.2013.06.025 BindingDB Entry DOI: 10.7270/Q2GF0VXW | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Aldo-keto-reductase family 1 member C3 (Homo sapiens (human)) | BDBM264492![]() (17-(5-fluoropyridin-3-yl)-N-[2-(1H-tetrazol-5-yl)e...) | PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet ![]() | PC cid PC sid UniChem | n/a | n/a | 5 | n/a | n/a | n/a | n/a | n/a | n/a | |
BAYER PHARMA AKTIENGESELLSCHAFT US Patent | Assay Description For the assay, 50 nl of a 100-fold concentrated solution of the test substance in DMSO were pipetted into a black low-volume 384-well microtitre plat... | US Patent US9714266 (2017) | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Aldo-keto-reductase family 1 member C3 (Homo sapiens (human)) | BDBM264493![]() (17-(5-fluoropyridin-3-yl)-N-(1H-tetrazol-5-ylmethy...) | PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet ![]() | PC cid PC sid UniChem | n/a | n/a | 5 | n/a | n/a | n/a | n/a | n/a | n/a | |
BAYER PHARMA AKTIENGESELLSCHAFT US Patent | Assay Description For the assay, 50 nl of a 100-fold concentrated solution of the test substance in DMSO were pipetted into a black low-volume 384-well microtitre plat... | US Patent US9714266 (2017) | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Aldo-keto-reductase family 1 member C3 (Homo sapiens (human)) | BDBM264510![]() (N-ethyl-17-(5-fluoropyridin-3-yl)oestra-1,3,5(10),...) | PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet ![]() | PC cid PC sid UniChem | n/a | n/a | 5 | n/a | n/a | n/a | n/a | n/a | n/a | |
BAYER PHARMA AKTIENGESELLSCHAFT US Patent | Assay Description For the assay, 50 nl of a 100-fold concentrated solution of the test substance in DMSO were pipetted into a black low-volume 384-well microtitre plat... | US Patent US9714266 (2017) | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Aldo-keto-reductase family 1 member C3 (Homo sapiens (human)) | BDBM264498![]() (17-(5-fluoropyridin-3-yl)-N-[3-(methylamino)-3-oxo...) | PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet ![]() | PC cid PC sid UniChem | n/a | n/a | 5 | n/a | n/a | n/a | n/a | n/a | n/a | |
BAYER PHARMA AKTIENGESELLSCHAFT US Patent | Assay Description For the assay, 50 nl of a 100-fold concentrated solution of the test substance in DMSO were pipetted into a black low-volume 384-well microtitre plat... | US Patent US9714266 (2017) | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Aldo-keto-reductase family 1 member C3 (Homo sapiens (human)) | BDBM264508![]() (17-(5-fluoropyridin-3-yl)-N-[2-(methylsulphinyl)et...) | PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet ![]() | PC cid PC sid UniChem | n/a | n/a | 5 | n/a | n/a | n/a | n/a | n/a | n/a | |
BAYER PHARMA AKTIENGESELLSCHAFT US Patent | Assay Description For the assay, 50 nl of a 100-fold concentrated solution of the test substance in DMSO were pipetted into a black low-volume 384-well microtitre plat... | US Patent US9714266 (2017) | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Aldo-keto-reductase family 1 member C3 (Homo sapiens (human)) | BDBM264497![]() (N-(3-amino-3-oxopropyl)-17-(5-fluoropyridin-3-yl)o...) | PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet ![]() | PC cid PC sid UniChem | n/a | n/a | 5 | n/a | n/a | n/a | n/a | n/a | n/a | |
BAYER PHARMA AKTIENGESELLSCHAFT US Patent | Assay Description For the assay, 50 nl of a 100-fold concentrated solution of the test substance in DMSO were pipetted into a black low-volume 384-well microtitre plat... | US Patent US9714266 (2017) | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Aldo-keto-reductase family 1 member C3 (Homo sapiens (human)) | BDBM264472![]() (17-(pyridin-3-yl)oestra-1,3,5(10),16-tetraene-3-ca...) | PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet ![]() | PC cid PC sid UniChem | n/a | n/a | 6 | n/a | n/a | n/a | n/a | n/a | n/a | |
BAYER PHARMA AKTIENGESELLSCHAFT US Patent | Assay Description For the assay, 50 nl of a 100-fold concentrated solution of the test substance in DMSO were pipetted into a black low-volume 384-well microtitre plat... | US Patent US9714266 (2017) | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Aldo-keto-reductase family 1 member C3 (Homo sapiens (human)) | BDBM264505![]() (17-(5-fluoropyridin-3-yl)-N-(3-hydroxypropyl)-N-me...) | PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet ![]() | PC cid PC sid UniChem | n/a | n/a | 6 | n/a | n/a | n/a | n/a | n/a | n/a | |
BAYER PHARMA AKTIENGESELLSCHAFT US Patent | Assay Description For the assay, 50 nl of a 100-fold concentrated solution of the test substance in DMSO were pipetted into a black low-volume 384-well microtitre plat... | US Patent US9714266 (2017) | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Aldo-keto-reductase family 1 member C3 (Homo sapiens (human)) | BDBM264507![]() (N?[(R)-2,3-dihydroxypropyl]-17-(5-fluoropyridin-3-...) | PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet ![]() | PC cid PC sid UniChem | n/a | n/a | 6 | n/a | n/a | n/a | n/a | n/a | n/a | |
BAYER PHARMA AKTIENGESELLSCHAFT US Patent | Assay Description For the assay, 50 nl of a 100-fold concentrated solution of the test substance in DMSO were pipetted into a black low-volume 384-well microtitre plat... | US Patent US9714266 (2017) | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Aldo-keto-reductase family 1 member C3 (Homo sapiens (human)) | BDBM264515![]() (17-(5-fluoropyridin-3-yl)-N?[(S)-2-hydroxypropyl]o...) | PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet ![]() | PC cid PC sid UniChem | n/a | n/a | 6 | n/a | n/a | n/a | n/a | n/a | n/a | |
BAYER PHARMA AKTIENGESELLSCHAFT US Patent | Assay Description For the assay, 50 nl of a 100-fold concentrated solution of the test substance in DMSO were pipetted into a black low-volume 384-well microtitre plat... | US Patent US9714266 (2017) | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Aldo-keto-reductase family 1 member C3 (Homo sapiens (human)) | BDBM264516![]() (17-(5-fluoropyridin-3-yl)-N?[(S)-2-hydroxypropyl]o...) | PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet ![]() | PC cid PC sid UniChem | n/a | n/a | 6 | n/a | n/a | n/a | n/a | n/a | n/a | |
BAYER PHARMA AKTIENGESELLSCHAFT US Patent | Assay Description For the assay, 50 nl of a 100-fold concentrated solution of the test substance in DMSO were pipetted into a black low-volume 384-well microtitre plat... | US Patent US9714266 (2017) | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
17-beta-Hydroxysteroid Dehydrogenase 5 (17-beta-HSD5, AKR1C3) (Homo sapiens (human)) | BDBM50396653![]() (CHEMBL2172122) | PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet ![]() | CHEMBL PC cid PC sid UniChem Similars | Article PubMed | n/a | n/a | 6 | n/a | n/a | n/a | n/a | n/a | n/a |
Guangzhou Medical University Curated by ChEMBL | Assay Description Inhibition of human recombinant His-tagged AKR1C3 expressed in Escherichia coli BL21 (DE3) cells using 8-Acetyl-2,3,5,6-tetrahydro-1H,4H-11-oxa-3a-az... | Bioorg Med Chem Lett 26: 5631-5638 (2016) Article DOI: 10.1016/j.bmcl.2016.10.073 BindingDB Entry DOI: 10.7270/Q200043M | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
17-beta-Hydroxysteroid Dehydrogenase 5 (17-beta-HSD5, AKR1C3) (Homo sapiens (human)) | BDBM50267368![]() ((8R,9S,13S,14S,17R)-5',13-Dimethyl-4',5',6,7,8,9,1...) | PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet ![]() | CHEMBL PC cid PC sid UniChem Similars | Article PubMed | n/a | n/a | 6.10 | n/a | n/a | n/a | n/a | n/a | n/a |
CHUL Research Center and University Laval Curated by ChEMBL | Assay Description Inhibition of human 17beta-HSD5 expressed in HEK293 cells assessed as enzyme-mediated transformation of [14C]-4-androstene-3,17-dione in to [14C]-tes... | Eur J Med Chem 44: 632-44 (2009) Article DOI: 10.1016/j.ejmech.2008.03.020 BindingDB Entry DOI: 10.7270/Q2K64HWB | |||||||||||
More data for this Ligand-Target Pair | ![]() 3D Structure (docked) | ||||||||||||
Aldo-keto-reductase family 1 member C3 (Homo sapiens (human)) | BDBM50396653![]() (CHEMBL2172122) | PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet ![]() | CHEMBL PC cid PC sid UniChem Similars | Article PubMed | n/a | n/a | 6.10 | n/a | n/a | n/a | n/a | n/a | n/a |
Guangzhou Medical University Curated by ChEMBL | Assay Description Inhibition of human recombinant His-tagged AKR1C3 expressed in Escherichia coli BL21 (DE3) cells using 8-Acetyl-2,3,5,6-tetrahydro-1H,4H-11-oxa-3a-az... | Bioorg Med Chem Lett 26: 5631-5638 (2016) Article DOI: 10.1016/j.bmcl.2016.10.073 BindingDB Entry DOI: 10.7270/Q200043M | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
17-beta-Hydroxysteroid Dehydrogenase 5 (17-beta-HSD5, AKR1C3) (Homo sapiens (human)) | BDBM50396653![]() (CHEMBL2172122) | PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet ![]() | CHEMBL PC cid PC sid UniChem Similars | Article PubMed | n/a | n/a | 6.10 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Auckland Curated by ChEMBL | Assay Description Inhibition of human recombinant N-terminal His6-tagged AKR1C3 expressed in Escherichia coli BL21(DE3) cells using 8-Acetyl-2,3,5,6-tetrahydro-1H,4H-1... | J Med Chem 55: 7746-58 (2012) Article DOI: 10.1021/jm3007867 BindingDB Entry DOI: 10.7270/Q28K7B6F | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Aldo-keto-reductase family 1 member C3 (Homo sapiens (human)) | BDBM264513![]() (17-(5-fluoropyridin-3-yl)-N-[(3-methyloxetan-3-yl)...) | PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet ![]() | PC cid PC sid UniChem | n/a | n/a | 7 | n/a | n/a | n/a | n/a | n/a | n/a | |
BAYER PHARMA AKTIENGESELLSCHAFT US Patent | Assay Description For the assay, 50 nl of a 100-fold concentrated solution of the test substance in DMSO were pipetted into a black low-volume 384-well microtitre plat... | US Patent US9714266 (2017) | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Aldo-keto-reductase family 1 member C3 (Homo sapiens (human)) | BDBM264511![]() (17-(5-fluoropyridin-3-yl)-N-(2-methoxyethyl)oestra...) | PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet ![]() | PC cid PC sid UniChem | n/a | n/a | 8 | n/a | n/a | n/a | n/a | n/a | n/a | |
BAYER PHARMA AKTIENGESELLSCHAFT US Patent | Assay Description For the assay, 50 nl of a 100-fold concentrated solution of the test substance in DMSO were pipetted into a black low-volume 384-well microtitre plat... | US Patent US9714266 (2017) | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
17-beta-Hydroxysteroid Dehydrogenase 5 (17-beta-HSD5, AKR1C3) (Homo sapiens (human)) | BDBM50396661![]() (CHEMBL2172110) | PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet ![]() | CHEMBL PC cid PC sid UniChem Similars | Article PubMed | n/a | n/a | 8.5 | n/a | n/a | n/a | n/a | n/a | n/a |
Guangzhou Medical University Curated by ChEMBL | Assay Description Inhibition of human recombinant His-tagged AKR1C3 expressed in Escherichia coli BL21 (DE3) cells using 8-Acetyl-2,3,5,6-tetrahydro-1H,4H-11-oxa-3a-az... | Bioorg Med Chem Lett 26: 5631-5638 (2016) Article DOI: 10.1016/j.bmcl.2016.10.073 BindingDB Entry DOI: 10.7270/Q200043M | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Aldo-keto-reductase family 1 member C3 (Homo sapiens (human)) | BDBM50396661![]() (CHEMBL2172110) | PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet ![]() | CHEMBL PC cid PC sid UniChem Similars | Article PubMed | n/a | n/a | 8.60 | n/a | n/a | n/a | n/a | n/a | n/a |
Guangzhou Medical University Curated by ChEMBL | Assay Description Inhibition of human recombinant His-tagged AKR1C3 expressed in Escherichia coli BL21 (DE3) cells using 8-Acetyl-2,3,5,6-tetrahydro-1H,4H-11-oxa-3a-az... | Bioorg Med Chem Lett 26: 5631-5638 (2016) Article DOI: 10.1016/j.bmcl.2016.10.073 BindingDB Entry DOI: 10.7270/Q200043M | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
17-beta-Hydroxysteroid Dehydrogenase 5 (17-beta-HSD5, AKR1C3) (Homo sapiens (human)) | BDBM50396661![]() (CHEMBL2172110) | PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet ![]() | CHEMBL PC cid PC sid UniChem Similars | Article PubMed | n/a | n/a | 8.60 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Auckland Curated by ChEMBL | Assay Description Inhibition of human recombinant N-terminal His6-tagged AKR1C3 expressed in Escherichia coli BL21(DE3) cells using 8-Acetyl-2,3,5,6-tetrahydro-1H,4H-1... | J Med Chem 55: 7746-58 (2012) Article DOI: 10.1021/jm3007867 BindingDB Entry DOI: 10.7270/Q28K7B6F | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Aldo-keto-reductase family 1 member C3 (Homo sapiens (human)) | BDBM50396695![]() (CHEMBL2172121) | PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet ![]() | CHEMBL PC cid PC sid UniChem Similars | Article PubMed | n/a | n/a | 8.70 | n/a | n/a | n/a | n/a | n/a | n/a |
Guangzhou Medical University Curated by ChEMBL | Assay Description Inhibition of human recombinant His-tagged AKR1C3 expressed in Escherichia coli BL21 (DE3) cells using 8-Acetyl-2,3,5,6-tetrahydro-1H,4H-11-oxa-3a-az... | Bioorg Med Chem Lett 26: 5631-5638 (2016) Article DOI: 10.1016/j.bmcl.2016.10.073 BindingDB Entry DOI: 10.7270/Q200043M | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
17-beta-Hydroxysteroid Dehydrogenase 5 (17-beta-HSD5, AKR1C3) (Homo sapiens (human)) | BDBM50396695![]() (CHEMBL2172121) | PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet ![]() | CHEMBL PC cid PC sid UniChem Similars | Article PubMed | n/a | n/a | 8.70 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Auckland Curated by ChEMBL | Assay Description Inhibition of human recombinant N-terminal His6-tagged AKR1C3 expressed in Escherichia coli BL21(DE3) cells using 8-Acetyl-2,3,5,6-tetrahydro-1H,4H-1... | J Med Chem 55: 7746-58 (2012) Article DOI: 10.1021/jm3007867 BindingDB Entry DOI: 10.7270/Q28K7B6F | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
17-beta-Hydroxysteroid Dehydrogenase 5 (17-beta-HSD5, AKR1C3) (Homo sapiens (human)) | BDBM50396695![]() (CHEMBL2172121) | PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet ![]() | CHEMBL PC cid PC sid UniChem Similars | Article PubMed | n/a | n/a | 8.70 | n/a | n/a | n/a | n/a | n/a | n/a |
Guangzhou Medical University Curated by ChEMBL | Assay Description Inhibition of human recombinant His-tagged AKR1C3 expressed in Escherichia coli BL21 (DE3) cells using 8-Acetyl-2,3,5,6-tetrahydro-1H,4H-11-oxa-3a-az... | Bioorg Med Chem Lett 26: 5631-5638 (2016) Article DOI: 10.1016/j.bmcl.2016.10.073 BindingDB Entry DOI: 10.7270/Q200043M | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
17-beta-Hydroxysteroid Dehydrogenase 5 (17-beta-HSD5, AKR1C3) (Homo sapiens (human)) | BDBM50396694![]() (CHEMBL2172112) | PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet ![]() | CHEMBL PC cid PC sid UniChem Similars | Article PubMed | n/a | n/a | 8.90 | n/a | n/a | n/a | n/a | n/a | n/a |
Guangzhou Medical University Curated by ChEMBL | Assay Description Inhibition of human recombinant His-tagged AKR1C3 expressed in Escherichia coli BL21 (DE3) cells using 8-Acetyl-2,3,5,6-tetrahydro-1H,4H-11-oxa-3a-az... | Bioorg Med Chem Lett 26: 5631-5638 (2016) Article DOI: 10.1016/j.bmcl.2016.10.073 BindingDB Entry DOI: 10.7270/Q200043M | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
17-beta-Hydroxysteroid Dehydrogenase 5 (17-beta-HSD5, AKR1C3) (Homo sapiens (human)) | BDBM50396694![]() (CHEMBL2172112) | PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet ![]() | CHEMBL PC cid PC sid UniChem Similars | Article PubMed | n/a | n/a | 8.90 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Auckland Curated by ChEMBL | Assay Description Inhibition of human recombinant N-terminal His6-tagged AKR1C3 expressed in Escherichia coli BL21(DE3) cells using 8-Acetyl-2,3,5,6-tetrahydro-1H,4H-1... | J Med Chem 55: 7746-58 (2012) Article DOI: 10.1021/jm3007867 BindingDB Entry DOI: 10.7270/Q28K7B6F | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Aldo-keto-reductase family 1 member C3 (Homo sapiens (human)) | BDBM50396694![]() (CHEMBL2172112) | PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet ![]() | CHEMBL PC cid PC sid UniChem Similars | Article PubMed | n/a | n/a | 8.90 | n/a | n/a | n/a | n/a | n/a | n/a |
Guangzhou Medical University Curated by ChEMBL | Assay Description Inhibition of human recombinant His-tagged AKR1C3 expressed in Escherichia coli BL21 (DE3) cells using 8-Acetyl-2,3,5,6-tetrahydro-1H,4H-11-oxa-3a-az... | Bioorg Med Chem Lett 26: 5631-5638 (2016) Article DOI: 10.1016/j.bmcl.2016.10.073 BindingDB Entry DOI: 10.7270/Q200043M | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Aldo-keto-reductase family 1 member C3 (Homo sapiens (human)) | BDBM264494![]() (17-(3-pyridyl)-N-(2-sulphamoylethyl)oestra-1,3,5(1...) | PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet ![]() | PC cid PC sid UniChem | n/a | n/a | 9 | n/a | n/a | n/a | n/a | n/a | n/a | |
BAYER PHARMA AKTIENGESELLSCHAFT US Patent | Assay Description For the assay, 50 nl of a 100-fold concentrated solution of the test substance in DMSO were pipetted into a black low-volume 384-well microtitre plat... | US Patent US9714266 (2017) | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Aldo-keto-reductase family 1 member C3 (Homo sapiens (human)) | BDBM264499![]() (17-(5-fluoropyridin-3-yl)oestra-1,3,5(10),16-tetra...) | PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet ![]() | PC cid PC sid UniChem | n/a | n/a | 9 | n/a | n/a | n/a | n/a | n/a | n/a | |
BAYER PHARMA AKTIENGESELLSCHAFT US Patent | Assay Description For the assay, 50 nl of a 100-fold concentrated solution of the test substance in DMSO were pipetted into a black low-volume 384-well microtitre plat... | US Patent US9714266 (2017) | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
17-beta-Hydroxysteroid Dehydrogenase 5 (17-beta-HSD5, AKR1C3) (Homo sapiens (human)) | BDBM17286![]() ((2R,15'S)-5'-(2-methoxyethoxy)-5,5,15'-trimethyl-6...) | PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet ![]() | PC cid PC sid UniChem Patents | Article PubMed | n/a | n/a | 9.5 | n/a | n/a | n/a | n/a | 6.0 | 22 |
CHUL | Assay Description SPA beads conjugated to anti-mouse IgG were incubated overnight in buffer with anti-testosterone monoclonal antibody. The enzymatic reaction was moni... | J Biol Chem 282: 8368-79 (2007) Article DOI: 10.1074/jbc.M606784200 BindingDB Entry DOI: 10.7270/Q27H1GVB | |||||||||||
More data for this Ligand-Target Pair | ![]() 3D Structure (docked) |
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