target,target_id,target_uniprot,target_species,ligand,ligand_id,ligand_species,ligand_pubchem_cid,smiles,inchi,inchikey,type,action,action_comment,endogenous,primary_target,concentration_range,affinity_parameter,affinity_high,affinity_median,affinity_low,original_affinity_units,original_affinity_low_nm,original_affinity_median_nm,original_affinity_high_nm,original_affinity_relation,assay_description,receptor_site,ligand_context,pubmed_id mitogen-activated protein kinase kinase kinase 5,2080,Q99683,Human,MSC2032964A,8076,,25214468,O=C(c1cccnc1)Nc1nn2c(n1)cc(cc2NC1CC1)C(F)(F)F,"InChI=1S/C16H13F3N6O/c17-16(18,19)10-6-12(21-11-3-4-11)25-13(7-10)22-15(24-25)23-14(26)9-2-1-5-20-8-9/h1-2,5-8,11,21H,3-4H2,(H,23,24,26)",XUKGFHHTSUKORV-UHFFFAOYSA-N,Inhibitor,Inhibition,,,yes,,pIC50,,7.03,,IC50,,93.0,,=,,,,21064192, mitogen-activated protein kinase kinase kinase 5,2080,Q99683,Human,compound 10 [PMID: 23147077],8133,,24944925,O=C(c1ccc(cc1)C(C)(C)C)Nc1cn2c(n1)ccc(c2)n1cncc1,"InChI=1S/C21H21N5O/c1-21(2,3)16-6-4-15(5-7-16)20(27)24-18-13-26-12-17(8-9-19(26)23-18)25-11-10-22-14-25/h4-14H,1-3H3,(H,24,27)",SMJAMOAYGIVKRI-UHFFFAOYSA-N,Inhibitor,Inhibition,,,yes,,pIC50,,8.0,,IC50,,10.0,,=,,,,23147077, mitogen-activated protein kinase kinase kinase 5,2080,Q99683,Human,selonsertib,9040,,71245288,O=C(c1cc(c(cc1F)C)n1cnc(c1)C1CC1)Nc1cccc(n1)c1nncn1C(C)C,"InChI=1S/C24H24FN7O/c1-14(2)32-13-27-30-23(32)19-5-4-6-22(28-19)29-24(33)17-10-21(15(3)9-18(17)25)31-11-20(26-12-31)16-7-8-16/h4-6,9-14,16H,7-8H2,1-3H3,(H,28,29,33)",YIDDLAAKOYYGJG-UHFFFAOYSA-N,Inhibitor,Inhibition,,,yes,,pIC50,,8.49,,IC50,,3.2,,=,"Determined is aTR-FRET immunoassay, measuring phosphorylation of a biotinylated peptide substrate by ASK1 kinase.",,,, mitogen-activated protein kinase kinase kinase 5,2080,Q99683,Human,GS-444217,10430,,57504987,O=C(c1nccc(c1)n1cnc(c1)C1CC1)Nc1cccc(c1)c1nncn1C1CC1,"InChI=1S/C23H21N7O/c31-23(20-11-19(8-9-24-20)29-12-21(25-13-29)15-4-5-15)27-17-3-1-2-16(10-17)22-28-26-14-30(22)18-6-7-18/h1-3,8-15,18H,4-7H2,(H,27,31)",ZGCMQKWOUIMBEP-UHFFFAOYSA-N,Inhibitor,Inhibition,,,yes,,pIC50,,8.54,,IC50,,2.9,,=,Determined in a TR-FRET immunoassay.,,,26180085, mitogen-activated protein kinase kinase kinase 5,2080,Q99683,Human,compound 26 [PMID: 31710475],10602,,142411827,CN(CCn1ncc(c1)c1ccc2c(c1)C(=O)Nc1cccc(n1)c1n(CCCCO2)cnn1)C,"InChI=1S/C25H28N8O2/c1-31(2)11-12-33-16-19(15-27-33)18-8-9-22-20(14-18)25(34)29-23-7-5-6-21(28-23)24-30-26-17-32(24)10-3-4-13-35-22/h5-9,14-17H,3-4,10-13H2,1-2H3,(H,28,29,34)",JGKCBXMHIQSQHJ-UHFFFAOYSA-N,Inhibitor,Inhibition,,,,,pIC50,,8.22,,IC50,,6.0,,=,Biochemical assay; inhibition of ASK1 autophosphorylation.,,,31710475, mitogen-activated protein kinase kinase kinase 5,2080,Q99683,Human,compound 26 [PMID: 31710475],10602,,142411827,CN(CCn1ncc(c1)c1ccc2c(c1)C(=O)Nc1cccc(n1)c1n(CCCCO2)cnn1)C,"InChI=1S/C25H28N8O2/c1-31(2)11-12-33-16-19(15-27-33)18-8-9-22-20(14-18)25(34)29-23-7-5-6-21(28-23)24-30-26-17-32(24)10-3-4-13-35-22/h5-9,14-17H,3-4,10-13H2,1-2H3,(H,28,29,34)",JGKCBXMHIQSQHJ-UHFFFAOYSA-N,Inhibitor,Inhibition,,,,,pIC50,,6.83,,IC50,,148.0,,=,Cellular assay; inhibition of ASK1-T838 autophosphorylation in HEK293T cells.,,,31710475,