Compile Data Set for Download or QSAR

Found 308 hits with Last Name = 'yngve' and Initial = 'u'   

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
Dihydroorotate dehydrogenase (quinone), mitochondrial (Homo sapiens (Human))	BDBM477604 ((R)—N-(1-(2-methylphenyl)-4,5,6,7-tetrahydro-1H-in...) Show SMILES Cc1ccccc1-n1ncc2[C@@H](CCCc12)NC(=O)c1noc2CCCCc12 |r| Show InChI InChI=1S/C22H24N4O2/c1-14-7-2-4-10-18(14)26-19-11-6-9-17(16(19)13-23-26)24-22(27)21-15-8-3-5-12-20(15)28-25-21/h2,4,7,10,13,17H,3,5-6,8-9,11-12H2,1H3,(H,24,27)/t17-/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.20	n/a	n/a	n/a	n/a	n/a	n/a
Karolinska Institutet Curated by ChEMBL					Assay Description Inhibition of recombinant human DHODH using dihydroorotic acid as substrate in presence of 2 nM of DHODH by DCIP assay				J Med Chem 63: 3915-3934 (2020) Article DOI: 10.1021/acs.jmedchem.9b01658 BindingDB Entry DOI: 10.7270/Q2HQ43F3
					More data for this Ligand-Target Pair
Dihydroorotate dehydrogenase (quinone), mitochondrial (Homo sapiens (Human))	BDBM477604 ((R)—N-(1-(2-methylphenyl)-4,5,6,7-tetrahydro-1H-in...) Show SMILES Cc1ccccc1-n1ncc2[C@@H](CCCc12)NC(=O)c1noc2CCCCc12 |r| Show InChI InChI=1S/C22H24N4O2/c1-14-7-2-4-10-18(14)26-19-11-6-9-17(16(19)13-23-26)24-22(27)21-15-8-3-5-12-20(15)28-25-21/h2,4,7,10,13,17H,3,5-6,8-9,11-12H2,1H3,(H,24,27)/t17-/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.20	n/a	n/a	n/a	n/a	n/a	n/a
Karolinska Institutet Curated by ChEMBL					Assay Description Inhibition of recombinant human DHODH using dihydroorotic acid as substrate measured for 68 mins by DCIP based colorimetric assay				J Med Chem 63: 3915-3934 (2020) Article DOI: 10.1021/acs.jmedchem.9b01658 BindingDB Entry DOI: 10.7270/Q2HQ43F3
					More data for this Ligand-Target Pair
Dihydroorotate dehydrogenase (quinone), mitochondrial (Homo sapiens (Human))	BDBM477616 ((R)—N-(1-(2-fluorophenyl)-4,5,6,7-tetrahydro-1H-in...) Show SMILES Fc1ccccc1-n1ncc2[C@@H](CCCc12)NC(=O)c1ncn2CCCCc12 |r| Show InChI InChI=1S/C21H22FN5O/c22-15-6-1-2-8-18(15)27-17-10-5-7-16(14(17)12-24-27)25-21(28)20-19-9-3-4-11-26(19)13-23-20/h1-2,6,8,12-13,16H,3-5,7,9-11H2,(H,25,28)/t16-/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	2.30	n/a	n/a	n/a	n/a	n/a	n/a
Karolinska Institutet Curated by ChEMBL					Assay Description Inhibition of recombinant human DHODH using dihydroorotic acid as substrate in presence of 2 nM of DHODH by DCIP assay				J Med Chem 63: 3915-3934 (2020) Article DOI: 10.1021/acs.jmedchem.9b01658 BindingDB Entry DOI: 10.7270/Q2HQ43F3
					More data for this Ligand-Target Pair
Dihydroorotate dehydrogenase (quinone), mitochondrial (Homo sapiens (Human))	BDBM477601 (N-[1-(2,3-dimethylphenyl)-4,5,6,7-tetrahydro-1H-in...) Show SMILES Cc1cccc(c1C)-n1ncc2C(CCCc12)NC(=O)c1noc2CCCCc12 Show InChI InChI=1S/C23H26N4O2/c1-14-7-5-10-19(15(14)2)27-20-11-6-9-18(17(20)13-24-27)25-23(28)22-16-8-3-4-12-21(16)29-26-22/h5,7,10,13,18H,3-4,6,8-9,11-12H2,1-2H3,(H,25,28)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	2.70	n/a	n/a	n/a	n/a	n/a	n/a
Karolinska Institutet Curated by ChEMBL					Assay Description Inhibition of recombinant human DHODH using dihydroorotic acid as substrate measured for 68 mins by DCIP based colorimetric assay				J Med Chem 63: 3915-3934 (2020) Article DOI: 10.1021/acs.jmedchem.9b01658 BindingDB Entry DOI: 10.7270/Q2HQ43F3
					More data for this Ligand-Target Pair
Dihydroorotate dehydrogenase (quinone), mitochondrial (Homo sapiens (Human))	BDBM477601 (N-[1-(2,3-dimethylphenyl)-4,5,6,7-tetrahydro-1H-in...) Show SMILES Cc1cccc(c1C)-n1ncc2C(CCCc12)NC(=O)c1noc2CCCCc12 Show InChI InChI=1S/C23H26N4O2/c1-14-7-5-10-19(15(14)2)27-20-11-6-9-18(17(20)13-24-27)25-23(28)22-16-8-3-4-12-21(16)29-26-22/h5,7,10,13,18H,3-4,6,8-9,11-12H2,1-2H3,(H,25,28)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	2.70	n/a	n/a	n/a	n/a	n/a	n/a
Karolinska Institutet Curated by ChEMBL					Assay Description Inhibition of recombinant human DHODH using dihydroorotic acid as substrate in presence of 2 nM of DHODH by DCIP assay				J Med Chem 63: 3915-3934 (2020) Article DOI: 10.1021/acs.jmedchem.9b01658 BindingDB Entry DOI: 10.7270/Q2HQ43F3
					More data for this Ligand-Target Pair
Dihydroorotate dehydrogenase (quinone), mitochondrial (Homo sapiens (Human))	BDBM477604 ((R)—N-(1-(2-methylphenyl)-4,5,6,7-tetrahydro-1H-in...) Show SMILES Cc1ccccc1-n1ncc2[C@@H](CCCc12)NC(=O)c1noc2CCCCc12 |r| Show InChI InChI=1S/C22H24N4O2/c1-14-7-2-4-10-18(14)26-19-11-6-9-17(16(19)13-23-26)24-22(27)21-15-8-3-5-12-20(15)28-25-21/h2,4,7,10,13,17H,3,5-6,8-9,11-12H2,1H3,(H,24,27)/t17-/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	3	n/a	n/a	n/a	n/a	n/a	n/a
Genase Therapeutics B.V. US Patent					Assay Description Assay B: Example compounds as described herein were dispensed with an acoustic liquid handler, Echo 550 (Labcyte) to a maximum volume of 50 nl per we...				US Patent US10889564 (2021) BindingDB Entry DOI: 10.7270/Q2N019MP
					More data for this Ligand-Target Pair
Dihydroorotate dehydrogenase (quinone), mitochondrial (Homo sapiens (Human))	BDBM477599 (N-[1-(2-methylphenyl)-4,5,6,7-tetrahydro-1H-indazo...) Show SMILES Cc1ccccc1-n1ncc2C(CCCc12)NC(=O)c1noc2CCCCc12 Show InChI InChI=1S/C22H24N4O2/c1-14-7-2-4-10-18(14)26-19-11-6-9-17(16(19)13-23-26)24-22(27)21-15-8-3-5-12-20(15)28-25-21/h2,4,7,10,13,17H,3,5-6,8-9,11-12H2,1H3,(H,24,27)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	3.5	n/a	n/a	n/a	n/a	n/a	n/a
Karolinska Institutet Curated by ChEMBL					Assay Description Inhibition of recombinant human DHODH using dihydroorotic acid as substrate in presence of 2 nM of DHODH by DCIP assay				J Med Chem 63: 3915-3934 (2020) Article DOI: 10.1021/acs.jmedchem.9b01658 BindingDB Entry DOI: 10.7270/Q2HQ43F3
					More data for this Ligand-Target Pair
Dihydroorotate dehydrogenase (quinone), mitochondrial (Homo sapiens (Human))	BDBM477599 (N-[1-(2-methylphenyl)-4,5,6,7-tetrahydro-1H-indazo...) Show SMILES Cc1ccccc1-n1ncc2C(CCCc12)NC(=O)c1noc2CCCCc12 Show InChI InChI=1S/C22H24N4O2/c1-14-7-2-4-10-18(14)26-19-11-6-9-17(16(19)13-23-26)24-22(27)21-15-8-3-5-12-20(15)28-25-21/h2,4,7,10,13,17H,3,5-6,8-9,11-12H2,1H3,(H,24,27)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	3.80	n/a	n/a	n/a	n/a	n/a	n/a
Karolinska Institutet Curated by ChEMBL					Assay Description Inhibition of recombinant human DHODH using dihydroorotic acid as substrate measured for 68 mins by DCIP based colorimetric assay				J Med Chem 63: 3915-3934 (2020) Article DOI: 10.1021/acs.jmedchem.9b01658 BindingDB Entry DOI: 10.7270/Q2HQ43F3
					More data for this Ligand-Target Pair
Dihydroorotate dehydrogenase (quinone), mitochondrial (Homo sapiens (Human))	BDBM477601 (N-[1-(2,3-dimethylphenyl)-4,5,6,7-tetrahydro-1H-in...) Show SMILES Cc1cccc(c1C)-n1ncc2C(CCCc12)NC(=O)c1noc2CCCCc12 Show InChI InChI=1S/C23H26N4O2/c1-14-7-5-10-19(15(14)2)27-20-11-6-9-18(17(20)13-24-27)25-23(28)22-16-8-3-4-12-21(16)29-26-22/h5,7,10,13,18H,3-4,6,8-9,11-12H2,1-2H3,(H,25,28)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	4	n/a	n/a	n/a	n/a	n/a	n/a
Genase Therapeutics B.V. US Patent					Assay Description Assay B: Example compounds as described herein were dispensed with an acoustic liquid handler, Echo 550 (Labcyte) to a maximum volume of 50 nl per we...				US Patent US10889564 (2021) BindingDB Entry DOI: 10.7270/Q2N019MP
					More data for this Ligand-Target Pair
Dihydroorotate dehydrogenase (quinone), mitochondrial (Homo sapiens (Human))	BDBM477616 ((R)—N-(1-(2-fluorophenyl)-4,5,6,7-tetrahydro-1H-in...) Show SMILES Fc1ccccc1-n1ncc2[C@@H](CCCc12)NC(=O)c1ncn2CCCCc12 |r| Show InChI InChI=1S/C21H22FN5O/c22-15-6-1-2-8-18(15)27-17-10-5-7-16(14(17)12-24-27)25-21(28)20-19-9-3-4-11-26(19)13-23-20/h1-2,6,8,12-13,16H,3-5,7,9-11H2,(H,25,28)/t16-/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	<5	n/a	n/a	n/a	n/a	n/a	n/a
Karolinska Institutet Curated by ChEMBL					Assay Description Inhibition of recombinant human DHODH using dihydroorotic acid as substrate measured for 68 mins by DCIP based colorimetric assay				J Med Chem 63: 3915-3934 (2020) Article DOI: 10.1021/acs.jmedchem.9b01658 BindingDB Entry DOI: 10.7270/Q2HQ43F3
					More data for this Ligand-Target Pair
Dihydroorotate dehydrogenase (quinone), mitochondrial (Homo sapiens (Human))	BDBM477599 (N-[1-(2-methylphenyl)-4,5,6,7-tetrahydro-1H-indazo...) Show SMILES Cc1ccccc1-n1ncc2C(CCCc12)NC(=O)c1noc2CCCCc12 Show InChI InChI=1S/C22H24N4O2/c1-14-7-2-4-10-18(14)26-19-11-6-9-17(16(19)13-23-26)24-22(27)21-15-8-3-5-12-20(15)28-25-21/h2,4,7,10,13,17H,3,5-6,8-9,11-12H2,1H3,(H,24,27)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	5	n/a	n/a	n/a	n/a	n/a	n/a
Genase Therapeutics B.V. US Patent					Assay Description Assay B: Example compounds as described herein were dispensed with an acoustic liquid handler, Echo 550 (Labcyte) to a maximum volume of 50 nl per we...				US Patent US10889564 (2021) BindingDB Entry DOI: 10.7270/Q2N019MP
					More data for this Ligand-Target Pair
Dihydroorotate dehydrogenase (quinone), mitochondrial (Homo sapiens (Human))	BDBM477616 ((R)—N-(1-(2-fluorophenyl)-4,5,6,7-tetrahydro-1H-in...) Show SMILES Fc1ccccc1-n1ncc2[C@@H](CCCc12)NC(=O)c1ncn2CCCCc12 |r| Show InChI InChI=1S/C21H22FN5O/c22-15-6-1-2-8-18(15)27-17-10-5-7-16(14(17)12-24-27)25-21(28)20-19-9-3-4-11-26(19)13-23-20/h1-2,6,8,12-13,16H,3-5,7,9-11H2,(H,25,28)/t16-/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	6	n/a	n/a	n/a	n/a	n/a	n/a
Genase Therapeutics B.V. US Patent					Assay Description Assay B: Example compounds as described herein were dispensed with an acoustic liquid handler, Echo 550 (Labcyte) to a maximum volume of 50 nl per we...				US Patent US10889564 (2021) BindingDB Entry DOI: 10.7270/Q2N019MP
					More data for this Ligand-Target Pair
Dihydroorotate dehydrogenase (quinone), mitochondrial (Homo sapiens (Human))	BDBM477618 ((R)—N-(1-(2-fluorophenyl)-4,5,6,7-tetrahydro-1H-in...) Show SMILES Fc1ccccc1-n1ncc2[C@@H](CCCc12)NC(=O)c1ncc2ccccn12 |r| Show InChI InChI=1S/C21H18FN5O/c22-16-7-1-2-9-19(16)27-18-10-5-8-17(15(18)13-24-27)25-21(28)20-23-12-14-6-3-4-11-26(14)20/h1-4,6-7,9,11-13,17H,5,8,10H2,(H,25,28)/t17-/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	6.30	n/a	n/a	n/a	n/a	n/a	n/a
Karolinska Institutet Curated by ChEMBL					Assay Description Inhibition of recombinant human DHODH using dihydroorotic acid as substrate measured for 68 mins by DCIP based colorimetric assay				J Med Chem 63: 3915-3934 (2020) Article DOI: 10.1021/acs.jmedchem.9b01658 BindingDB Entry DOI: 10.7270/Q2HQ43F3
					More data for this Ligand-Target Pair
Dihydroorotate dehydrogenase (quinone), mitochondrial (Homo sapiens (Human))	BDBM477586 (N-[(4R)-1-(2-methylphenyl)-4,5,6,7-tetrahydro-1H-i...) Show SMILES Cc1ccccc1-n1ncc2[C@@H](CCCc12)NC(=O)c1onc2CCCCc12 |r| Show InChI InChI=1S/C22H24N4O2/c1-14-7-2-5-11-19(14)26-20-12-6-10-17(16(20)13-23-26)24-22(27)21-15-8-3-4-9-18(15)25-28-21/h2,5,7,11,13,17H,3-4,6,8-10,12H2,1H3,(H,24,27)/t17-/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	7	n/a	n/a	n/a	n/a	n/a	n/a
Karolinska Institutet Curated by ChEMBL					Assay Description Inhibition of recombinant human DHODH using dihydroorotic acid as substrate measured for 68 mins by DCIP based colorimetric assay				J Med Chem 63: 3915-3934 (2020) Article DOI: 10.1021/acs.jmedchem.9b01658 BindingDB Entry DOI: 10.7270/Q2HQ43F3
					More data for this Ligand-Target Pair
Dihydroorotate dehydrogenase (quinone), mitochondrial (Homo sapiens (Human))	BDBM477618 ((R)—N-(1-(2-fluorophenyl)-4,5,6,7-tetrahydro-1H-in...) Show SMILES Fc1ccccc1-n1ncc2[C@@H](CCCc12)NC(=O)c1ncc2ccccn12 |r| Show InChI InChI=1S/C21H18FN5O/c22-16-7-1-2-9-19(16)27-18-10-5-8-17(15(18)13-24-27)25-21(28)20-23-12-14-6-3-4-11-26(14)20/h1-4,6-7,9,11-13,17H,5,8,10H2,(H,25,28)/t17-/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	8	n/a	n/a	n/a	n/a	n/a	n/a
Genase Therapeutics B.V. US Patent					Assay Description Assay B: Example compounds as described herein were dispensed with an acoustic liquid handler, Echo 550 (Labcyte) to a maximum volume of 50 nl per we...				US Patent US10889564 (2021) BindingDB Entry DOI: 10.7270/Q2N019MP
					More data for this Ligand-Target Pair
Dihydroorotate dehydrogenase (quinone), mitochondrial (Homo sapiens (Human))	BDBM477600 (N-[1-(3-methylphenyl)-4,5,6,7-tetrahydro-1H-indazo...) Show SMILES Cc1cccc(c1)-n1ncc2C(CCCc12)NC(=O)c1noc2CCCCc12 Show InChI InChI=1S/C22H24N4O2/c1-14-6-4-7-15(12-14)26-19-10-5-9-18(17(19)13-23-26)24-22(27)21-16-8-2-3-11-20(16)28-25-21/h4,6-7,12-13,18H,2-3,5,8-11H2,1H3,(H,24,27)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	9	n/a	n/a	n/a	n/a	n/a	n/a
Genase Therapeutics B.V. US Patent					Assay Description Assay B: Example compounds as described herein were dispensed with an acoustic liquid handler, Echo 550 (Labcyte) to a maximum volume of 50 nl per we...				US Patent US10889564 (2021) BindingDB Entry DOI: 10.7270/Q2N019MP
					More data for this Ligand-Target Pair
Dihydroorotate dehydrogenase (quinone), mitochondrial (Homo sapiens (Human))	BDBM477584 (N-[(4R)-1-(2-fluorophenyl)-4,5,6,7-tetrahydro-1H-i...) Show SMILES Fc1ccccc1-n1ncc2[C@@H](CCCc12)NC(=O)c1onc2CCCCc12 |r| Show InChI InChI=1S/C21H21FN4O2/c22-15-7-2-4-10-19(15)26-18-11-5-9-16(14(18)12-23-26)24-21(27)20-13-6-1-3-8-17(13)25-28-20/h2,4,7,10,12,16H,1,3,5-6,8-9,11H2,(H,24,27)/t16-/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase PC cid PC sid UniChem	US Patent	n/a	n/a	9	n/a	n/a	n/a	n/a	n/a	n/a
Genase Therapeutics B.V. US Patent					Assay Description Assay B: Example compounds as described herein were dispensed with an acoustic liquid handler, Echo 550 (Labcyte) to a maximum volume of 50 nl per we...				US Patent US10889564 (2021) BindingDB Entry DOI: 10.7270/Q2N019MP
					More data for this Ligand-Target Pair
Dihydroorotate dehydrogenase (quinone), mitochondrial (Homo sapiens (Human))	BDBM477583 (N-[(4R)-1-(2-fluorophenyl)-4,5,6,7-tetrahydro-1H-i...) Show SMILES Fc1ccccc1-n1ncc2[C@@H](CCCc12)NC(=O)c1noc2CCCCc12 |r| Show InChI InChI=1S/C21H21FN4O2/c22-15-7-2-3-9-18(15)26-17-10-5-8-16(14(17)12-23-26)24-21(27)20-13-6-1-4-11-19(13)28-25-20/h2-3,7,9,12,16H,1,4-6,8,10-11H2,(H,24,27)/t16-/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	9	n/a	n/a	n/a	n/a	n/a	n/a
Karolinska Institutet Curated by ChEMBL					Assay Description Inhibition of recombinant human DHODH using dihydroorotic acid as substrate measured for 68 mins by DCIP based colorimetric assay				J Med Chem 63: 3915-3934 (2020) Article DOI: 10.1021/acs.jmedchem.9b01658 BindingDB Entry DOI: 10.7270/Q2HQ43F3
					More data for this Ligand-Target Pair
Dihydroorotate dehydrogenase (quinone), mitochondrial (Homo sapiens (Human))	BDBM477586 (N-[(4R)-1-(2-methylphenyl)-4,5,6,7-tetrahydro-1H-i...) Show SMILES Cc1ccccc1-n1ncc2[C@@H](CCCc12)NC(=O)c1onc2CCCCc12 |r| Show InChI InChI=1S/C22H24N4O2/c1-14-7-2-5-11-19(14)26-20-12-6-10-17(16(20)13-23-26)24-22(27)21-15-8-3-4-9-18(15)25-28-21/h2,5,7,11,13,17H,3-4,6,8-10,12H2,1H3,(H,24,27)/t17-/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	9	n/a	n/a	n/a	n/a	n/a	n/a
Genase Therapeutics B.V. US Patent					Assay Description Assay B: Example compounds as described herein were dispensed with an acoustic liquid handler, Echo 550 (Labcyte) to a maximum volume of 50 nl per we...				US Patent US10889564 (2021) BindingDB Entry DOI: 10.7270/Q2N019MP
					More data for this Ligand-Target Pair
Dihydroorotate dehydrogenase (quinone), mitochondrial (Homo sapiens (Human))	BDBM477583 (N-[(4R)-1-(2-fluorophenyl)-4,5,6,7-tetrahydro-1H-i...) Show SMILES Fc1ccccc1-n1ncc2[C@@H](CCCc12)NC(=O)c1noc2CCCCc12 |r| Show InChI InChI=1S/C21H21FN4O2/c22-15-7-2-3-9-18(15)26-17-10-5-8-16(14(17)12-23-26)24-21(27)20-13-6-1-4-11-19(13)28-25-20/h2-3,7,9,12,16H,1,4-6,8,10-11H2,(H,24,27)/t16-/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	11	n/a	n/a	n/a	n/a	n/a	n/a
Genase Therapeutics B.V. US Patent					Assay Description Assay B: Example compounds as described herein were dispensed with an acoustic liquid handler, Echo 550 (Labcyte) to a maximum volume of 50 nl per we...				US Patent US10889564 (2021) BindingDB Entry DOI: 10.7270/Q2N019MP
					More data for this Ligand-Target Pair
Dihydroorotate dehydrogenase (quinone), mitochondrial (Homo sapiens (Human))	BDBM477584 (N-[(4R)-1-(2-fluorophenyl)-4,5,6,7-tetrahydro-1H-i...) Show SMILES Fc1ccccc1-n1ncc2[C@@H](CCCc12)NC(=O)c1onc2CCCCc12 |r| Show InChI InChI=1S/C21H21FN4O2/c22-15-7-2-4-10-19(15)26-18-11-5-9-16(14(18)12-23-26)24-21(27)20-13-6-1-3-8-17(13)25-28-20/h2,4,7,10,12,16H,1,3,5-6,8-9,11H2,(H,24,27)/t16-/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase PC cid PC sid UniChem	Article PubMed	n/a	n/a	11	n/a	n/a	n/a	n/a	n/a	n/a
Karolinska Institutet Curated by ChEMBL					Assay Description Inhibition of recombinant human N-terminal His-tagged DHODH (31 to 395 residues) expressed in Escherichia coli expression system using dihydroorotic ...				J Med Chem 63: 3915-3934 (2020) Article DOI: 10.1021/acs.jmedchem.9b01658 BindingDB Entry DOI: 10.7270/Q2HQ43F3
					More data for this Ligand-Target Pair
Dihydroorotate dehydrogenase (quinone), mitochondrial (Homo sapiens (Human))	BDBM477619 ((R)—N-(1-(2-fluoro-5-methylphenyl)-4,5,6,7-tetrahy...) Show SMILES Cc1ccc(F)c(c1)-n1ncc2[C@@H](CCCc12)NC(=O)c1onc2CCCCc12 |r| Show InChI InChI=1S/C22H23FN4O2/c1-13-9-10-16(23)20(11-13)27-19-8-4-7-17(15(19)12-24-27)25-22(28)21-14-5-2-3-6-18(14)26-29-21/h9-12,17H,2-8H2,1H3,(H,25,28)/t17-/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	11	n/a	n/a	n/a	n/a	n/a	n/a
Karolinska Institutet Curated by ChEMBL					Assay Description Inhibition of recombinant human DHODH using dihydroorotic acid as substrate measured for 68 mins by DCIP based colorimetric assay				J Med Chem 63: 3915-3934 (2020) Article DOI: 10.1021/acs.jmedchem.9b01658 BindingDB Entry DOI: 10.7270/Q2HQ43F3
					More data for this Ligand-Target Pair
Dihydroorotate dehydrogenase (quinone), mitochondrial (Homo sapiens (Human))	BDBM477622 (Propan-2-yl-3-[(4R)-4-(4,5,6,7-tetrahydro-1,2-benz...) Show SMILES CC(C)OC(=O)c1cccc(c1)-n1ncc2[C@@H](CCCc12)NC(=O)c1noc2CCCCc12 |r| Show InChI InChI=1S/C25H28N4O4/c1-15(2)32-25(31)16-7-5-8-17(13-16)29-21-11-6-10-20(19(21)14-26-29)27-24(30)23-18-9-3-4-12-22(18)33-28-23/h5,7-8,13-15,20H,3-4,6,9-12H2,1-2H3,(H,27,30)/t20-/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	11	n/a	n/a	n/a	n/a	n/a	n/a
Genase Therapeutics B.V. US Patent					Assay Description Assay B: Example compounds as described herein were dispensed with an acoustic liquid handler, Echo 550 (Labcyte) to a maximum volume of 50 nl per we...				US Patent US10889564 (2021) BindingDB Entry DOI: 10.7270/Q2N019MP
					More data for this Ligand-Target Pair
Dihydroorotate dehydrogenase (quinone), mitochondrial (Homo sapiens (Human))	BDBM477600 (N-[1-(3-methylphenyl)-4,5,6,7-tetrahydro-1H-indazo...) Show SMILES Cc1cccc(c1)-n1ncc2C(CCCc12)NC(=O)c1noc2CCCCc12 Show InChI InChI=1S/C22H24N4O2/c1-14-6-4-7-15(12-14)26-19-10-5-9-18(17(19)13-23-26)24-22(27)21-16-8-2-3-11-20(16)28-25-21/h4,6-7,12-13,18H,2-3,5,8-11H2,1H3,(H,24,27)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	12	n/a	n/a	n/a	n/a	n/a	n/a
Karolinska Institutet Curated by ChEMBL					Assay Description Inhibition of recombinant human DHODH using dihydroorotic acid as substrate measured for 68 mins by DCIP based colorimetric assay				J Med Chem 63: 3915-3934 (2020) Article DOI: 10.1021/acs.jmedchem.9b01658 BindingDB Entry DOI: 10.7270/Q2HQ43F3
					More data for this Ligand-Target Pair
Dihydroorotate dehydrogenase (quinone), mitochondrial (Homo sapiens (Human))	BDBM477595 (4-methyl-N-[(4R)-1-(2-methylphenyl)-4,5,6,7-tetrah...) Show SMILES Cc1ccnc(c1)C(=O)N[C@@H]1CCCc2c1cnn2-c1ccccc1C |r| Show InChI InChI=1S/C21H22N4O/c1-14-10-11-22-18(12-14)21(26)24-17-7-5-9-20-16(17)13-23-25(20)19-8-4-3-6-15(19)2/h3-4,6,8,10-13,17H,5,7,9H2,1-2H3,(H,24,26)/t17-/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	14	n/a	n/a	n/a	n/a	n/a	n/a
Genase Therapeutics B.V. US Patent					Assay Description Assay B: Example compounds as described herein were dispensed with an acoustic liquid handler, Echo 550 (Labcyte) to a maximum volume of 50 nl per we...				US Patent US10889564 (2021) BindingDB Entry DOI: 10.7270/Q2N019MP
					More data for this Ligand-Target Pair
Dihydroorotate dehydrogenase (quinone), mitochondrial (Homo sapiens (Human))	BDBM477609 (N-[(4R)-1-(2-fluorophenyl)-4,5,6,7-tetrahydro-1H-i...) Show SMILES Fc1ccccc1-n1ncc2[C@@H](CCCc12)NC(=O)c1cc(ccn1)C(F)(F)F |r| Show InChI InChI=1S/C20H16F4N4O/c21-14-4-1-2-6-18(14)28-17-7-3-5-15(13(17)11-26-28)27-19(29)16-10-12(8-9-25-16)20(22,23)24/h1-2,4,6,8-11,15H,3,5,7H2,(H,27,29)/t15-/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	15	n/a	n/a	n/a	n/a	n/a	n/a
Karolinska Institutet Curated by ChEMBL					Assay Description Inhibition of recombinant human DHODH using dihydroorotic acid as substrate measured for 68 mins by DCIP based colorimetric assay				J Med Chem 63: 3915-3934 (2020) Article DOI: 10.1021/acs.jmedchem.9b01658 BindingDB Entry DOI: 10.7270/Q2HQ43F3
					More data for this Ligand-Target Pair
Dihydroorotate dehydrogenase (quinone), mitochondrial (Homo sapiens (Human))	BDBM477619 ((R)—N-(1-(2-fluoro-5-methylphenyl)-4,5,6,7-tetrahy...) Show SMILES Cc1ccc(F)c(c1)-n1ncc2[C@@H](CCCc12)NC(=O)c1onc2CCCCc12 |r| Show InChI InChI=1S/C22H23FN4O2/c1-13-9-10-16(23)20(11-13)27-19-8-4-7-17(15(19)12-24-27)25-22(28)21-14-5-2-3-6-18(14)26-29-21/h9-12,17H,2-8H2,1H3,(H,25,28)/t17-/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	17	n/a	n/a	n/a	n/a	n/a	n/a
Genase Therapeutics B.V. US Patent					Assay Description Assay B: Example compounds as described herein were dispensed with an acoustic liquid handler, Echo 550 (Labcyte) to a maximum volume of 50 nl per we...				US Patent US10889564 (2021) BindingDB Entry DOI: 10.7270/Q2N019MP
					More data for this Ligand-Target Pair
Dihydroorotate dehydrogenase (quinone), mitochondrial (Homo sapiens (Human))	BDBM477595 (4-methyl-N-[(4R)-1-(2-methylphenyl)-4,5,6,7-tetrah...) Show SMILES Cc1ccnc(c1)C(=O)N[C@@H]1CCCc2c1cnn2-c1ccccc1C |r| Show InChI InChI=1S/C21H22N4O/c1-14-10-11-22-18(12-14)21(26)24-17-7-5-9-20-16(17)13-23-25(20)19-8-4-3-6-15(19)2/h3-4,6,8,10-13,17H,5,7,9H2,1-2H3,(H,24,26)/t17-/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	17	n/a	n/a	n/a	n/a	n/a	n/a
Karolinska Institutet Curated by ChEMBL					Assay Description Inhibition of recombinant human DHODH using dihydroorotic acid as substrate measured for 68 mins by DCIP based colorimetric assay				J Med Chem 63: 3915-3934 (2020) Article DOI: 10.1021/acs.jmedchem.9b01658 BindingDB Entry DOI: 10.7270/Q2HQ43F3
					More data for this Ligand-Target Pair
Dihydroorotate dehydrogenase (quinone), mitochondrial (Homo sapiens (Human))	BDBM477598 (N-[(4R)-1-(2-fluorophenyl)-4,5,6,7-tetrahydro-1H-i...) Show SMILES Fc1ccccc1-n1ncc2[C@@H](CCCc12)NC(=O)c1noc2ccccc12 |r| Show InChI InChI=1S/C21H17FN4O2/c22-15-7-2-3-9-18(15)26-17-10-5-8-16(14(17)12-23-26)24-21(27)20-13-6-1-4-11-19(13)28-25-20/h1-4,6-7,9,11-12,16H,5,8,10H2,(H,24,27)/t16-/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	18	n/a	n/a	n/a	n/a	n/a	n/a
Genase Therapeutics B.V. US Patent					Assay Description Assay B: Example compounds as described herein were dispensed with an acoustic liquid handler, Echo 550 (Labcyte) to a maximum volume of 50 nl per we...				US Patent US10889564 (2021) BindingDB Entry DOI: 10.7270/Q2N019MP
					More data for this Ligand-Target Pair
Dihydroorotate dehydrogenase (quinone), mitochondrial (Homo sapiens (Human))	BDBM477592 (N-(1-phenyl-4,5,6,7-tetrahydro-1H-indazol-4-yl)-4,...) Show SMILES O=C(NC1CCCc2c1cnn2-c1ccccc1)c1noc2CCCCc12 Show InChI InChI=1S/C21H22N4O2/c26-21(20-15-9-4-5-12-19(15)27-24-20)23-17-10-6-11-18-16(17)13-22-25(18)14-7-2-1-3-8-14/h1-3,7-8,13,17H,4-6,9-12H2,(H,23,26)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	19	n/a	n/a	n/a	n/a	n/a	n/a
Karolinska Institutet Curated by ChEMBL					Assay Description Inhibition of recombinant human DHODH using dihydroorotic acid as substrate measured for 68 mins by DCIP based colorimetric assay				J Med Chem 63: 3915-3934 (2020) Article DOI: 10.1021/acs.jmedchem.9b01658 BindingDB Entry DOI: 10.7270/Q2HQ43F3
					More data for this Ligand-Target Pair
Dihydroorotate dehydrogenase (quinone), mitochondrial (Homo sapiens (Human))	BDBM477614 (N-[(4R)-1-(2-fluorophenyl)-4,5,6,7-tetrahydro-1H-i...) Show SMILES Cc1cnc(cc1C)C(=O)N[C@@H]1CCCc2c1cnn2-c1ccccc1F |r| Show InChI InChI=1S/C21H21FN4O/c1-13-10-18(23-11-14(13)2)21(27)25-17-7-5-9-19-15(17)12-24-26(19)20-8-4-3-6-16(20)22/h3-4,6,8,10-12,17H,5,7,9H2,1-2H3,(H,25,27)/t17-/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	21	n/a	n/a	n/a	n/a	n/a	n/a
Karolinska Institutet Curated by ChEMBL					Assay Description Inhibition of recombinant human DHODH using dihydroorotic acid as substrate measured for 68 mins by DCIP based colorimetric assay				J Med Chem 63: 3915-3934 (2020) Article DOI: 10.1021/acs.jmedchem.9b01658 BindingDB Entry DOI: 10.7270/Q2HQ43F3
					More data for this Ligand-Target Pair
Dihydroorotate dehydrogenase (quinone), mitochondrial (Homo sapiens (Human))	BDBM477621 (N-[(4R)-1-(2-fluoro-5-methylphenyl)-4,5,6,7-tetrah...) Show SMILES Cc1ccnc(c1)C(=O)N[C@@H]1CCCc2c1cnn2-c1cc(C)ccc1F |r| Show InChI InChI=1S/C21H21FN4O/c1-13-6-7-16(22)20(11-13)26-19-5-3-4-17(15(19)12-24-26)25-21(27)18-10-14(2)8-9-23-18/h6-12,17H,3-5H2,1-2H3,(H,25,27)/t17-/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	23	n/a	n/a	n/a	n/a	n/a	n/a
Karolinska Institutet Curated by ChEMBL					Assay Description Inhibition of recombinant human DHODH using dihydroorotic acid as substrate measured for 68 mins by DCIP based colorimetric assay				J Med Chem 63: 3915-3934 (2020) Article DOI: 10.1021/acs.jmedchem.9b01658 BindingDB Entry DOI: 10.7270/Q2HQ43F3
					More data for this Ligand-Target Pair
Dihydroorotate dehydrogenase (quinone), mitochondrial (Homo sapiens (Human))	BDBM477609 (N-[(4R)-1-(2-fluorophenyl)-4,5,6,7-tetrahydro-1H-i...) Show SMILES Fc1ccccc1-n1ncc2[C@@H](CCCc12)NC(=O)c1cc(ccn1)C(F)(F)F |r| Show InChI InChI=1S/C20H16F4N4O/c21-14-4-1-2-6-18(14)28-17-7-3-5-15(13(17)11-26-28)27-19(29)16-10-12(8-9-25-16)20(22,23)24/h1-2,4,6,8-11,15H,3,5,7H2,(H,27,29)/t15-/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	25	n/a	n/a	n/a	n/a	n/a	n/a
Genase Therapeutics B.V. US Patent					Assay Description Assay B: Example compounds as described herein were dispensed with an acoustic liquid handler, Echo 550 (Labcyte) to a maximum volume of 50 nl per we...				US Patent US10889564 (2021) BindingDB Entry DOI: 10.7270/Q2N019MP
					More data for this Ligand-Target Pair
Dihydroorotate dehydrogenase (quinone), mitochondrial (Homo sapiens (Human))	BDBM477606 (4-chloro-N-[(4R)-1-(2-fluorophenyl)-4,5,6,7-tetrah...) Show SMILES Fc1ccccc1-n1ncc2[C@@H](CCCc12)NC(=O)c1cc(Cl)ccn1 |r| Show InChI InChI=1S/C19H16ClFN4O/c20-12-8-9-22-16(10-12)19(26)24-15-5-3-7-17-13(15)11-23-25(17)18-6-2-1-4-14(18)21/h1-2,4,6,8-11,15H,3,5,7H2,(H,24,26)/t15-/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	26	n/a	n/a	n/a	n/a	n/a	n/a
Karolinska Institutet Curated by ChEMBL					Assay Description Inhibition of recombinant human DHODH using dihydroorotic acid as substrate measured for 68 mins by DCIP based colorimetric assay				J Med Chem 63: 3915-3934 (2020) Article DOI: 10.1021/acs.jmedchem.9b01658 BindingDB Entry DOI: 10.7270/Q2HQ43F3
					More data for this Ligand-Target Pair
Dihydroorotate dehydrogenase (quinone), mitochondrial (Homo sapiens (Human))	BDBM477607 (4-bromo-N-[(4R)-1-(2-fluorophenyl)-4,5,6,7-tetrahy...) Show SMILES Fc1ccccc1-n1ncc2[C@@H](CCCc12)NC(=O)c1cc(Br)ccn1 |r| Show InChI InChI=1S/C19H16BrFN4O/c20-12-8-9-22-16(10-12)19(26)24-15-5-3-7-17-13(15)11-23-25(17)18-6-2-1-4-14(18)21/h1-2,4,6,8-11,15H,3,5,7H2,(H,24,26)/t15-/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	26	n/a	n/a	n/a	n/a	n/a	n/a
Karolinska Institutet Curated by ChEMBL					Assay Description Inhibition of recombinant human DHODH using dihydroorotic acid as substrate measured for 68 mins by DCIP based colorimetric assay				J Med Chem 63: 3915-3934 (2020) Article DOI: 10.1021/acs.jmedchem.9b01658 BindingDB Entry DOI: 10.7270/Q2HQ43F3
					More data for this Ligand-Target Pair
Dihydroorotate dehydrogenase (quinone), mitochondrial (Homo sapiens (Human))	BDBM477602 (Ethyl 3-[4-(4,5,6,7-tetrahydro-1,2-benzoxazole-3-a...) Show SMILES CCOC(=O)c1cccc(c1)-n1ncc2C(CCCc12)NC(=O)c1noc2CCCCc12 Show InChI InChI=1S/C24H26N4O4/c1-2-31-24(30)15-7-5-8-16(13-15)28-20-11-6-10-19(18(20)14-25-28)26-23(29)22-17-9-3-4-12-21(17)32-27-22/h5,7-8,13-14,19H,2-4,6,9-12H2,1H3,(H,26,29)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	30	n/a	n/a	n/a	n/a	n/a	n/a
Genase Therapeutics B.V. US Patent					Assay Description Assay B: Example compounds as described herein were dispensed with an acoustic liquid handler, Echo 550 (Labcyte) to a maximum volume of 50 nl per we...				US Patent US10889564 (2021) BindingDB Entry DOI: 10.7270/Q2N019MP
					More data for this Ligand-Target Pair
Dihydroorotate dehydrogenase (quinone), mitochondrial (Homo sapiens (Human))	BDBM477602 (Ethyl 3-[4-(4,5,6,7-tetrahydro-1,2-benzoxazole-3-a...) Show SMILES CCOC(=O)c1cccc(c1)-n1ncc2C(CCCc12)NC(=O)c1noc2CCCCc12 Show InChI InChI=1S/C24H26N4O4/c1-2-31-24(30)15-7-5-8-16(13-15)28-20-11-6-10-19(18(20)14-25-28)26-23(29)22-17-9-3-4-12-21(17)32-27-22/h5,7-8,13-14,19H,2-4,6,9-12H2,1H3,(H,26,29)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	30	n/a	n/a	n/a	n/a	n/a	n/a
Karolinska Institutet Curated by ChEMBL					Assay Description Inhibition of recombinant human DHODH using dihydroorotic acid as substrate measured for 68 mins by DCIP based colorimetric assay				J Med Chem 63: 3915-3934 (2020) Article DOI: 10.1021/acs.jmedchem.9b01658 BindingDB Entry DOI: 10.7270/Q2HQ43F3
					More data for this Ligand-Target Pair
Dihydroorotate dehydrogenase (quinone), mitochondrial (Homo sapiens (Human))	BDBM477617 (4-fluoro-N-[(4R)-1-(2-fluorophenyl)-4,5,6,7-tetrah...) Show SMILES Fc1ccnc(c1)C(=O)N[C@@H]1CCCc2c1cnn2-c1ccccc1F |r| Show InChI InChI=1S/C19H16F2N4O/c20-12-8-9-22-16(10-12)19(26)24-15-5-3-7-17-13(15)11-23-25(17)18-6-2-1-4-14(18)21/h1-2,4,6,8-11,15H,3,5,7H2,(H,24,26)/t15-/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	31	n/a	n/a	n/a	n/a	n/a	n/a
Karolinska Institutet Curated by ChEMBL					Assay Description Inhibition of recombinant human DHODH using dihydroorotic acid as substrate measured for 68 mins by DCIP based colorimetric assay				J Med Chem 63: 3915-3934 (2020) Article DOI: 10.1021/acs.jmedchem.9b01658 BindingDB Entry DOI: 10.7270/Q2HQ43F3
					More data for this Ligand-Target Pair
Dihydroorotate dehydrogenase (quinone), mitochondrial (Homo sapiens (Human))	BDBM477606 (4-chloro-N-[(4R)-1-(2-fluorophenyl)-4,5,6,7-tetrah...) Show SMILES Fc1ccccc1-n1ncc2[C@@H](CCCc12)NC(=O)c1cc(Cl)ccn1 |r| Show InChI InChI=1S/C19H16ClFN4O/c20-12-8-9-22-16(10-12)19(26)24-15-5-3-7-17-13(15)11-23-25(17)18-6-2-1-4-14(18)21/h1-2,4,6,8-11,15H,3,5,7H2,(H,24,26)/t15-/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	31	n/a	n/a	n/a	n/a	n/a	n/a
Genase Therapeutics B.V. US Patent					Assay Description Assay B: Example compounds as described herein were dispensed with an acoustic liquid handler, Echo 550 (Labcyte) to a maximum volume of 50 nl per we...				US Patent US10889564 (2021) BindingDB Entry DOI: 10.7270/Q2N019MP
					More data for this Ligand-Target Pair
Dihydroorotate dehydrogenase (quinone), mitochondrial (Homo sapiens (Human))	BDBM477592 (N-(1-phenyl-4,5,6,7-tetrahydro-1H-indazol-4-yl)-4,...) Show SMILES O=C(NC1CCCc2c1cnn2-c1ccccc1)c1noc2CCCCc12 Show InChI InChI=1S/C21H22N4O2/c26-21(20-15-9-4-5-12-19(15)27-24-20)23-17-10-6-11-18-16(17)13-22-25(18)14-7-2-1-3-8-14/h1-3,7-8,13,17H,4-6,9-12H2,(H,23,26)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	32	n/a	n/a	n/a	n/a	n/a	n/a
Genase Therapeutics B.V. US Patent					Assay Description Assay B: Example compounds as described herein were dispensed with an acoustic liquid handler, Echo 550 (Labcyte) to a maximum volume of 50 nl per we...				US Patent US10889564 (2021) BindingDB Entry DOI: 10.7270/Q2N019MP
					More data for this Ligand-Target Pair
Dihydroorotate dehydrogenase (quinone), mitochondrial (Homo sapiens (Human))	BDBM477579 (N-(1-(2-fluorophenyl)-4,5,6,7-tetrahydro-1H-indazo...) Show SMILES Fc1ccccc1-n1ncc2C(CCCc12)NC(=O)c1onc2CCCCc12 Show InChI InChI=1S/C21H21FN4O2/c22-15-7-2-4-10-19(15)26-18-11-5-9-16(14(18)12-23-26)24-21(27)20-13-6-1-3-8-17(13)25-28-20/h2,4,7,10,12,16H,1,3,5-6,8-9,11H2,(H,24,27)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase PC cid PC sid UniChem	US Patent	n/a	n/a	32	n/a	n/a	n/a	n/a	n/a	n/a
Genase Therapeutics B.V. US Patent					Assay Description Assay A: DHODH enzyme assays were performed with 6 nM recombinant human DHODH (purified essentially as described by Walse et. al., Biochemistry, 47, ...				US Patent US10889564 (2021) BindingDB Entry DOI: 10.7270/Q2N019MP
					More data for this Ligand-Target Pair
Dihydroorotate dehydrogenase (quinone), mitochondrial (Homo sapiens (Human))	BDBM477621 (N-[(4R)-1-(2-fluoro-5-methylphenyl)-4,5,6,7-tetrah...) Show SMILES Cc1ccnc(c1)C(=O)N[C@@H]1CCCc2c1cnn2-c1cc(C)ccc1F |r| Show InChI InChI=1S/C21H21FN4O/c1-13-6-7-16(22)20(11-13)26-19-5-3-4-17(15(19)12-24-26)25-21(27)18-10-14(2)8-9-23-18/h6-12,17H,3-5H2,1-2H3,(H,25,27)/t17-/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	32	n/a	n/a	n/a	n/a	n/a	n/a
Genase Therapeutics B.V. US Patent					Assay Description Assay B: Example compounds as described herein were dispensed with an acoustic liquid handler, Echo 550 (Labcyte) to a maximum volume of 50 nl per we...				US Patent US10889564 (2021) BindingDB Entry DOI: 10.7270/Q2N019MP
					More data for this Ligand-Target Pair
Dihydroorotate dehydrogenase (quinone), mitochondrial (Homo sapiens (Human))	BDBM477579 (N-(1-(2-fluorophenyl)-4,5,6,7-tetrahydro-1H-indazo...) Show SMILES Fc1ccccc1-n1ncc2C(CCCc12)NC(=O)c1onc2CCCCc12 Show InChI InChI=1S/C21H21FN4O2/c22-15-7-2-4-10-19(15)26-18-11-5-9-16(14(18)12-23-26)24-21(27)20-13-6-1-3-8-17(13)25-28-20/h2,4,7,10,12,16H,1,3,5-6,8-9,11H2,(H,24,27)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase PC cid PC sid UniChem	Article PubMed	n/a	n/a	32	n/a	n/a	n/a	n/a	n/a	n/a
Karolinska Institutet Curated by ChEMBL					Assay Description Inhibition of recombinant human N-terminal His-tagged DHODH (31 to 395 residues) expressed in Escherichia coli expression system using dihydroorotic ...				J Med Chem 63: 3915-3934 (2020) Article DOI: 10.1021/acs.jmedchem.9b01658 BindingDB Entry DOI: 10.7270/Q2HQ43F3
					More data for this Ligand-Target Pair
Dihydroorotate dehydrogenase (quinone), mitochondrial (Homo sapiens (Human))	BDBM477614 (N-[(4R)-1-(2-fluorophenyl)-4,5,6,7-tetrahydro-1H-i...) Show SMILES Cc1cnc(cc1C)C(=O)N[C@@H]1CCCc2c1cnn2-c1ccccc1F |r| Show InChI InChI=1S/C21H21FN4O/c1-13-10-18(23-11-14(13)2)21(27)25-17-7-5-9-19-15(17)12-24-26(19)20-8-4-3-6-16(20)22/h3-4,6,8,10-12,17H,5,7,9H2,1-2H3,(H,25,27)/t17-/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	33	n/a	n/a	n/a	n/a	n/a	n/a
Genase Therapeutics B.V. US Patent					Assay Description Assay B: Example compounds as described herein were dispensed with an acoustic liquid handler, Echo 550 (Labcyte) to a maximum volume of 50 nl per we...				US Patent US10889564 (2021) BindingDB Entry DOI: 10.7270/Q2N019MP
					More data for this Ligand-Target Pair
Dihydroorotate dehydrogenase (quinone), mitochondrial (Homo sapiens (Human))	BDBM477612 ((R)—N-(1-(2-fluorophenyl)-4,5,6,7-tetrahydro-1H-in...) Show SMILES Cc1ccnc(c1)C(=O)N[C@@H]1CCCc2c1cnn2-c1ccccc1F |r| Show InChI InChI=1S/C20H19FN4O/c1-13-9-10-22-17(11-13)20(26)24-16-6-4-8-18-14(16)12-23-25(18)19-7-3-2-5-15(19)21/h2-3,5,7,9-12,16H,4,6,8H2,1H3,(H,24,26)/t16-/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	34	n/a	n/a	n/a	n/a	n/a	n/a
Karolinska Institutet Curated by ChEMBL					Assay Description Inhibition of recombinant human DHODH using dihydroorotic acid as substrate measured for 68 mins by DCIP based colorimetric assay				J Med Chem 63: 3915-3934 (2020) Article DOI: 10.1021/acs.jmedchem.9b01658 BindingDB Entry DOI: 10.7270/Q2HQ43F3
					More data for this Ligand-Target Pair
Dihydroorotate dehydrogenase (quinone), mitochondrial (Homo sapiens (Human))	BDBM477607 (4-bromo-N-[(4R)-1-(2-fluorophenyl)-4,5,6,7-tetrahy...) Show SMILES Fc1ccccc1-n1ncc2[C@@H](CCCc12)NC(=O)c1cc(Br)ccn1 |r| Show InChI InChI=1S/C19H16BrFN4O/c20-12-8-9-22-16(10-12)19(26)24-15-5-3-7-17-13(15)11-23-25(17)18-6-2-1-4-14(18)21/h1-2,4,6,8-11,15H,3,5,7H2,(H,24,26)/t15-/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	39	n/a	n/a	n/a	n/a	n/a	n/a
Genase Therapeutics B.V. US Patent					Assay Description Assay B: Example compounds as described herein were dispensed with an acoustic liquid handler, Echo 550 (Labcyte) to a maximum volume of 50 nl per we...				US Patent US10889564 (2021) BindingDB Entry DOI: 10.7270/Q2N019MP
					More data for this Ligand-Target Pair
Dihydroorotate dehydrogenase (quinone), mitochondrial (Homo sapiens (Human))	BDBM477620 (N-[(4R)-1-(2-fluoro-5-methylphenyl)-4,5,6,7-tetrah...) Show SMILES Cc1ccc(F)c(c1)-n1ncc2[C@@H](CCCc12)NC(=O)c1cc(ccn1)C(F)(F)F |r| Show InChI InChI=1S/C21H18F4N4O/c1-12-5-6-15(22)19(9-12)29-18-4-2-3-16(14(18)11-27-29)28-20(30)17-10-13(7-8-26-17)21(23,24)25/h5-11,16H,2-4H2,1H3,(H,28,30)/t16-/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	40	n/a	n/a	n/a	n/a	n/a	n/a
Karolinska Institutet Curated by ChEMBL					Assay Description Inhibition of recombinant human DHODH using dihydroorotic acid as substrate measured for 68 mins by DCIP based colorimetric assay				J Med Chem 63: 3915-3934 (2020) Article DOI: 10.1021/acs.jmedchem.9b01658 BindingDB Entry DOI: 10.7270/Q2HQ43F3
					More data for this Ligand-Target Pair
Sodium channel protein type 9 subunit alpha (Homo sapiens (Human))	BDBM50395351 (CHEMBL2164363) Show SMILES FC(F)(F)Oc1ccc(CNC(=O)C2N(CC(F)(F)c3ccccn3)C(=O)c3ccccc23)cc1 Show InChI InChI=1S/C24H18F5N3O3/c25-23(26,19-7-3-4-12-30-19)14-32-20(17-5-1-2-6-18(17)22(32)34)21(33)31-13-15-8-10-16(11-9-15)35-24(27,28)29/h1-12,20H,13-14H2,(H,31,33)	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	45	n/a	n/a	n/a	n/a	n/a	n/a
AstraZeneca Curated by ChEMBL					Assay Description Inhibition of recombinant human NaV1.7 alpha subunit expressed in HEK293 cells at -65 mV holding potential by patch clamp electrophysiological assay				J Med Chem 55: 6866-80 (2012) Article DOI: 10.1021/jm300623u BindingDB Entry DOI: 10.7270/Q2M909SB
					More data for this Ligand-Target Pair
Dihydroorotate dehydrogenase (quinone), mitochondrial (Homo sapiens (Human))	BDBM477612 ((R)—N-(1-(2-fluorophenyl)-4,5,6,7-tetrahydro-1H-in...) Show SMILES Cc1ccnc(c1)C(=O)N[C@@H]1CCCc2c1cnn2-c1ccccc1F |r| Show InChI InChI=1S/C20H19FN4O/c1-13-9-10-22-17(11-13)20(26)24-16-6-4-8-18-14(16)12-23-25(18)19-7-3-2-5-15(19)21/h2-3,5,7,9-12,16H,4,6,8H2,1H3,(H,24,26)/t16-/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	47	n/a	n/a	n/a	n/a	n/a	n/a
Genase Therapeutics B.V. US Patent					Assay Description Assay B: Example compounds as described herein were dispensed with an acoustic liquid handler, Echo 550 (Labcyte) to a maximum volume of 50 nl per we...				US Patent US10889564 (2021) BindingDB Entry DOI: 10.7270/Q2N019MP
					More data for this Ligand-Target Pair
Sodium channel protein type 9 subunit alpha (Homo sapiens (Human))	BDBM50395332 (CHEMBL2164390) Show SMILES FC(F)(F)Oc1cccc(CNC(=O)C2N(CCc3ccccn3)C(=O)c3ccccc23)c1 Show InChI InChI=1S/C24H20F3N3O3/c25-24(26,27)33-18-8-5-6-16(14-18)15-29-22(31)21-19-9-1-2-10-20(19)23(32)30(21)13-11-17-7-3-4-12-28-17/h1-10,12,14,21H,11,13,15H2,(H,29,31)	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	49	n/a	n/a	n/a	n/a	n/a	n/a
AstraZeneca Curated by ChEMBL					Assay Description Inhibition of recombinant human NaV1.7 alpha subunit expressed in HEK293 cells at -65 mV holding potential by patch clamp electrophysiological assay				J Med Chem 55: 6866-80 (2012) Article DOI: 10.1021/jm300623u BindingDB Entry DOI: 10.7270/Q2M909SB
					More data for this Ligand-Target Pair

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