31863CHEMBL663853Inhibitory concentration against human DNA topoisomerase II, alpha mediated relaxation of pBR322; no measurable activityBBAO_0000190BAO_0000357single protein formatc1ccc(-c2nc3c(-c4nc5ccccc5o4)cccc3o2)cc1CHEMBL1137930Bioorg Med Chem Lett2004CHEMBL113081CHEMBL113081http://www.openphacts.org/units/Nanomolar206172>11>IC50nM100000.0CHEMBL1806Homo sapiensDNA topoisomerase 2-alpha9606IC50uMUO_0000065100.031864CHEMBL872937In vivo inhibitory activity against human HeparanaseBBAO_0000190BAO_0000218organism-based formatCc1ccc2oc(-c3cccc(N4C(=O)c5ccc(C(=O)O)cc5C4=O)c3)nc2c1CHEMBL1146658Bioorg Med Chem Lett200414.060.261.305.56CHEMBL324340CHEMBL3243405.60http://www.openphacts.org/units/Nanomolar208970=11=IC50nM2500.0CHEMBL3921Homo sapiensHeparanase9606IC50uMUO_00000652.531865CHEMBL693237In vivo concentration required against angiogenesis in human endothelial cellsFBAO_0000190BAO_0000218organism-based formatCc1ccc2oc(-c3cccc(N4C(=O)c5ccc(C(=O)O)cc5C4=O)c3)nc2c1CHEMBL1146658Bioorg Med Chem Lett2004CHEMBL324340CHEMBL324340http://www.openphacts.org/units/Nanomolar208970>11>IC50nM50000.0CHEMBL3879801NON-PROTEIN TARGETIC50uMUO_000006550.031866CHEMBL872937In vivo inhibitory activity against human HeparanaseBBAO_0000190BAO_0000218organism-based formatCOc1ccccc1-c1ccc2oc(-c3ccc(OC)c(N4C(=O)c5ccc(C(=O)O)cc5C4=O)c3)nc2c1CHEMBL1146658Bioorg Med Chem Lett20049.690.18-0.634.23CHEMBL109600CHEMBL1096005.05http://www.openphacts.org/units/Nanomolar208987=11=IC50nM9000.0CHEMBL3921Homo sapiensHeparanase9606IC50uMUO_00000659.0Not Determined31867CHEMBL693238In vivo concentration required against angiogenesis in human endothelial cells; NT=Not testedFBAO_0000190BAO_0000218organism-based formatCOc1ccccc1-c1ccc2oc(-c3ccc(OC)c(N4C(=O)c5ccc(C(=O)O)cc5C4=O)c3)nc2c1CHEMBL1146658Bioorg Med Chem Lett2004CHEMBL109600CHEMBL109600http://www.openphacts.org/units/Nanomolar2089871IC50nMCHEMBL3879801NON-PROTEIN TARGETIC50uMUO_000006531868CHEMBL760688Inhibitory activity against Palmitoyl-CoA oxidase to inhibit rat heart mitochondrial Palmitoyl-CoA oxidation.BBAO_0000190BAO_0000357single protein formatCc1nc2cc(OC[C@H](O)CN3CCN(CC(=O)Nc4ccc(Cl)c(C(F)(F)F)c4)CC3)ccc2s1CHEMBL1148425Bioorg Med Chem Lett20049.940.201.136.93CHEMBL357278CHEMBL3572785.40http://www.openphacts.org/units/Nanomolar297547=11=IC50nM4000.0CHEMBL4632Rattus norvegicusPeroxisomal acyl-coenzyme A oxidase 110116IC50uMUO_00000654.031869CHEMBL623452Metabolic stability (% remaining at 30 mins) in human S9.ABAO_0000179BAO_0000019assay formatCc1nc2cc(OC[C@H](O)CN3CCN(CC(=O)Nc4ccc(Cl)c(C(F)(F)F)c4)CC3)ccc2s1CHEMBL1148425Bioorg Med Chem Lett2004CHEMBL357278CHEMBL357278http://qudt.org/vocab/unit#Percent297547=1=% remaining%25.0CHEMBL612558ADMET% remaining%UO_000018725.031870CHEMBL760688Inhibitory activity against Palmitoyl-CoA oxidase to inhibit rat heart mitochondrial Palmitoyl-CoA oxidation.BBAO_0000190BAO_0000357single protein formatCc1nc2cc(OC[C@H](O)CN3CCN(CC(=O)NCCc4ccccc4)CC3)ccc2s1CHEMBL1148425Bioorg Med Chem Lett200410.180.202.456.12CHEMBL357119CHEMBL3571194.77http://www.openphacts.org/units/Nanomolar297563=11=IC50nM17000.0CHEMBL4632Rattus norvegicusPeroxisomal acyl-coenzyme A oxidase 110116IC50uMUO_000006517.031871CHEMBL623452Metabolic stability (% remaining at 30 mins) in human S9.ABAO_0000179BAO_0000019assay formatCc1nc2cc(OC[C@H](O)CN3CCN(CC(=O)NCCc4ccccc4)CC3)ccc2s1CHEMBL1148425Bioorg Med Chem Lett2004CHEMBL357119CHEMBL357119http://qudt.org/vocab/unit#Percent297563=1=% remaining%27.0CHEMBL612558ADMET% remaining%UO_000018727.031872CHEMBL760688Inhibitory activity against Palmitoyl-CoA oxidase to inhibit rat heart mitochondrial Palmitoyl-CoA oxidation.BBAO_0000190BAO_0000357single protein formatCc1nc2cc(OC[C@H](O)CN3CCN(CC(=O)Nc4cccc(-c5ccccc5)c4)CC3)ccc2s1CHEMBL1148425Bioorg Med Chem Lett200413.050.252.478.65CHEMBL152968CHEMBL1529686.75http://www.openphacts.org/units/Nanomolar297580=11=IC50nM180.0CHEMBL4632Rattus norvegicusPeroxisomal acyl-coenzyme A oxidase 110116IC50nMUO_0000065180.031873CHEMBL623452Metabolic stability (% remaining at 30 mins) in human S9.ABAO_0000179BAO_0000019assay formatCc1nc2cc(OC[C@H](O)CN3CCN(CC(=O)Nc4cccc(-c5ccccc5)c4)CC3)ccc2s1CHEMBL1148425Bioorg Med Chem Lett2004CHEMBL152968CHEMBL152968http://qudt.org/vocab/unit#Percent297580=1=% remaining%58.0CHEMBL612558ADMET% remaining%UO_000018758.031874CHEMBL666153Inhibition of cytochrome P450 1A2 of isolated guinea pig heartABAO_0000190BAO_0000357single protein formatCc1nc2cc(OC[C@H](O)CN3CCN(CC(=O)Nc4cccc(-c5ccccc5)c4)CC3)ccc2s1CHEMBL1148425Bioorg Med Chem Lett2004CHEMBL152968CHEMBL1529685.22http://www.openphacts.org/units/Nanomolar297580=11=IC50nM6000.0CHEMBL3356Homo sapiensCytochrome P450 1A29606IC50uMUO_00000656.031875CHEMBL665756Inhibition of cytochrome P450 3A4 of isolated guinea pig heartABAO_0000190BAO_0000357single protein formatCc1nc2cc(OC[C@H](O)CN3CCN(CC(=O)Nc4cccc(-c5ccccc5)c4)CC3)ccc2s1CHEMBL1148425Bioorg Med Chem Lett2004CHEMBL152968CHEMBL1529684.43http://www.openphacts.org/units/Nanomolar297580=11=IC50nM37000.0CHEMBL340Homo sapiensCytochrome P450 3A49606IC50uMUO_000006537.031876CHEMBL660388Inhibition of cytochrome P450 2C9 of isolated guinea pig heartABAO_0000190BAO_0000357single protein formatCc1nc2cc(OC[C@H](O)CN3CCN(CC(=O)Nc4cccc(-c5ccccc5)c4)CC3)ccc2s1CHEMBL1148425Bioorg Med Chem Lett2004CHEMBL152968CHEMBL1529684.62http://www.openphacts.org/units/Nanomolar297580=11=IC50nM24000.0CHEMBL3397Homo sapiensCytochrome P450 2C99606IC50uMUO_000006524.031877CHEMBL684289Electrophysiological effect on isolated guinea pig heart as change in S-H interval at 3 uMFBAO_0000179BAO_0000218organism-based formatCc1nc2cc(OC[C@H](O)CN3CCN(CC(=O)Nc4cccc(-c5ccccc5)c4)CC3)ccc2s1CHEMBL1148425Bioorg Med Chem Lett2004CHEMBL152968CHEMBL152968http://qudt.org/vocab/unit#MilliSecond297580=1=Delta S-Hms3.0CHEMBL369Cavia porcellusCavia porcellus10141Delta S-HmsUO_00000283.031878CHEMBL684287Electrophysiological effect on isolated guinea pig heart as change in H-V interval at 3 uMFBAO_0000179BAO_0000218organism-based formatCc1nc2cc(OC[C@H](O)CN3CCN(CC(=O)Nc4cccc(-c5ccccc5)c4)CC3)ccc2s1CHEMBL1148425Bioorg Med Chem Lett2004CHEMBL152968CHEMBL152968http://qudt.org/vocab/unit#MilliSecond297580=1=Delta H-Vms0.0CHEMBL369Cavia porcellusCavia porcellus10141Delta H-VmsUO_00000280.031879CHEMBL684285Electrophysiological effect on isolated guinea pig heart as change in coronary perfusion pressure at 3 uMFBAO_0000179BAO_0000218organism-based formatCc1nc2cc(OC[C@H](O)CN3CCN(CC(=O)Nc4cccc(-c5ccccc5)c4)CC3)ccc2s1CHEMBL1148425Bioorg Med Chem Lett2004CHEMBL152968CHEMBL152968297580=1=Delta CPPmmHg-4.3CHEMBL369Cavia porcellusCavia porcellus10141Delta CPPmmHgUO_0000272-4.331880CHEMBL651396Effective concentration of compound achieving 50% protection in CEM cell lines against the cytopathic effect of HIV-1FBAO_0000188BAO_0000219cell-based formatCc1cn(C2C=CC(COC(=O)CN3CCNCC3)O2)c(=O)[nH]c1=OCHEMBL1138695Bioorg Med Chem Lett2004CHEMBL174698CHEMBL174698http://www.openphacts.org/units/Nanomolar350589<11<EC50nM63.6CHEMBL382Homo sapiensCCRF-CEM9606EC50uMUO_00000650.063631881CHEMBL657398Cytotoxic concentration of compound required to reduce the viability of mock infected CEM cells by 50%FBAO_0000187BAO_0000219cell-based formatCc1cn(C2C=CC(COC(=O)CN3CCNCC3)O2)c(=O)[nH]c1=OCHEMBL1138695Bioorg Med Chem Lett2004CHEMBL174698CHEMBL174698http://www.openphacts.org/units/Nanomolar350589>11>CC50nM1000000.0CHEMBL382Homo sapiensCCRF-CEM9606CC50uMUO_00000651000.031882CHEMBL845142Selectivity index expressed as the ratio of CC50 to EC50FBAO_0000179BAO_0000019assay formatCc1cn(C2C=CC(COC(=O)CN3CCNCC3)O2)c(=O)[nH]c1=OCHEMBL1138695Bioorg Med Chem Lett2004CHEMBL174698CHEMBL174698http://www.openphacts.org/units/Micromolar350589>1>Selectivity indexuM15723.0CHEMBL612545UncheckedSelectivity indexuMUO_000006415723.020/chembl/api/data/activity?limit=20&offset=2024267312