Compile Data Set for Download or QSAR

Found 65 hits with Last Name = 'nunomura' and Initial = 'k'   

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
Pituitary adenylate cyclase-activating polypeptide type I receptor (Homo sapiens (Human))	BDBM50596676 (CHEMBL5203375) Show SMILES Nc1nc2NC(=O)CC(c3cccc(OC(F)(F)F)c3)c2c(=O)[nH]1 Show InChI	PDB Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	0.110	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details Article DOI: 10.1016/j.ejmech.2022.114160 BindingDB Entry DOI: 10.7270/Q2CV4NRW
					More data for this Ligand-Target Pair
Pituitary adenylate cyclase-activating polypeptide type I receptor (Homo sapiens (Human))	BDBM50596675 (CHEMBL5208587) Show SMILES COc1cc(ccc1OCC=C)C1CC(=O)Nc2nc(N)[nH]c(=O)c12 Show InChI	PDB Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	Purchase MCE PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.5	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details Article DOI: 10.1016/j.ejmech.2022.114160 BindingDB Entry DOI: 10.7270/Q2CV4NRW
					More data for this Ligand-Target Pair
Histone deacetylase 6 (Mus musculus)	BDBM50594395 (CHEMBL5189146) Show SMILES ONC(=O)c1ccc(CN2CCN(CC2)C(c2ccccc2)c2ccccc2)cc1 Show InChI	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	110	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details Article DOI: 10.1021/acsmedchemlett.2c00081 BindingDB Entry DOI: 10.7270/Q2NG4VP5
					More data for this Ligand-Target Pair
Histone deacetylase 6 (Mus musculus)	BDBM50594401 (CHEMBL5192796) Show SMILES ONC(=O)c1ccc(CN2CCN(Cc3ccccc3)CC2)cc1 Show InChI	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	260	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details Article DOI: 10.1021/acsmedchemlett.2c00081 BindingDB Entry DOI: 10.7270/Q2NG4VP5
					More data for this Ligand-Target Pair
Histone deacetylase 6 (Mus musculus)	BDBM50594394 (CHEMBL5195750) Show SMILES CC(N1CCN(Cc2ccc(cc2)C(=O)NO)CC1)c1ccccc1 Show InChI	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	Purchase MCE PC cid PC sid UniChem	Article PubMed	n/a	n/a	260	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details Article DOI: 10.1021/acsmedchemlett.2c00081 BindingDB Entry DOI: 10.7270/Q2NG4VP5
					More data for this Ligand-Target Pair
Histone deacetylase 6 (Mus musculus)	BDBM50594396 (CHEMBL5172611) Show SMILES ONC(=O)c1ccc(CCN2CCN(CC2)C(c2ccccc2)c2ccccc2)cc1 Show InChI	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	330	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details Article DOI: 10.1021/acsmedchemlett.2c00081 BindingDB Entry DOI: 10.7270/Q2NG4VP5
					More data for this Ligand-Target Pair
Histone deacetylase 6 (Mus musculus)	BDBM50594398 (CHEMBL5175813) Show SMILES ONC(=O)c1ccc(CCCCN2CCN(CC2)C(c2ccccc2)c2ccccc2)cc1 Show InChI	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	430	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details Article DOI: 10.1021/acsmedchemlett.2c00081 BindingDB Entry DOI: 10.7270/Q2NG4VP5
					More data for this Ligand-Target Pair
Histone deacetylase 6 (Mus musculus)	BDBM50594397 (CHEMBL5193136) Show SMILES ONC(=O)c1ccc(CCCN2CCN(CC2)C(c2ccccc2)c2ccccc2)cc1 Show InChI	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	580	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details Article DOI: 10.1021/acsmedchemlett.2c00081 BindingDB Entry DOI: 10.7270/Q2NG4VP5
					More data for this Ligand-Target Pair
Potassium voltage-gated channel subfamily H member 2 (Homo sapiens (Human))	BDBM50594395 (CHEMBL5189146) Show SMILES ONC(=O)c1ccc(CN2CCN(CC2)C(c2ccccc2)c2ccccc2)cc1 Show InChI	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	660	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details Article DOI: 10.1021/acsmedchemlett.2c00081 BindingDB Entry DOI: 10.7270/Q2NG4VP5
					More data for this Ligand-Target Pair
Amine oxidase [flavin-containing] B (Homo sapiens (Human))	BDBM50593240 (CHEMBL5199677) Show SMILES COc1cc2CCN(Cc2cc1OC)c1ccc(C=O)cc1 Show InChI	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	Purchase MCE PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.55E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details Article DOI: 10.1021/acsmedchemlett.2c00228 BindingDB Entry DOI: 10.7270/Q2H70KTG
					More data for this Ligand-Target Pair
Histone deacetylase 4 (Homo sapiens (Human))	BDBM50594397 (CHEMBL5193136) Show SMILES ONC(=O)c1ccc(CCCN2CCN(CC2)C(c2ccccc2)c2ccccc2)cc1 Show InChI	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.90E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details Article DOI: 10.1021/acsmedchemlett.2c00081 BindingDB Entry DOI: 10.7270/Q2NG4VP5
					More data for this Ligand-Target Pair
Histone deacetylase 4 (Homo sapiens (Human))	BDBM50594396 (CHEMBL5172611) Show SMILES ONC(=O)c1ccc(CCN2CCN(CC2)C(c2ccccc2)c2ccccc2)cc1 Show InChI	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	3.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details Article DOI: 10.1021/acsmedchemlett.2c00081 BindingDB Entry DOI: 10.7270/Q2NG4VP5
					More data for this Ligand-Target Pair
Histone deacetylase 1 (Homo sapiens (Human))	BDBM50594397 (CHEMBL5193136) Show SMILES ONC(=O)c1ccc(CCCN2CCN(CC2)C(c2ccccc2)c2ccccc2)cc1 Show InChI	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	3.80E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details Article DOI: 10.1021/acsmedchemlett.2c00081 BindingDB Entry DOI: 10.7270/Q2NG4VP5
					More data for this Ligand-Target Pair
Histone deacetylase 4 (Homo sapiens (Human))	BDBM50594395 (CHEMBL5189146) Show SMILES ONC(=O)c1ccc(CN2CCN(CC2)C(c2ccccc2)c2ccccc2)cc1 Show InChI	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	4.40E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details Article DOI: 10.1021/acsmedchemlett.2c00081 BindingDB Entry DOI: 10.7270/Q2NG4VP5
					More data for this Ligand-Target Pair
Histone deacetylase 1 (Homo sapiens (Human))	BDBM50594395 (CHEMBL5189146) Show SMILES ONC(=O)c1ccc(CN2CCN(CC2)C(c2ccccc2)c2ccccc2)cc1 Show InChI	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	4.40E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details Article DOI: 10.1021/acsmedchemlett.2c00081 BindingDB Entry DOI: 10.7270/Q2NG4VP5
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor gamma (Homo sapiens (Human))	BDBM50521948 (CHEMBL4454999) Show SMILES CC(C)c1nn(-c2ccc(Cl)cc2)c2nc(C)cc(C(O)=O)c12 Show InChI InChI=1S/C17H16ClN3O2/c1-9(2)15-14-13(17(22)23)8-10(3)19-16(14)21(20-15)12-6-4-11(18)5-7-12/h4-9H,1-3H3,(H,22,23)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid PDB UniChem	Article PubMed	n/a	n/a	4.48E+3	n/a	n/a	n/a	n/a	n/a	n/a
Okayama University Curated by ChEMBL					Assay Description Displacement of fluormone pan-PPAR green from GST-tagged human PPARgamma ligand binding domain after 3 hrs by TR-FRET assay				Bioorg Med Chem Lett 29: 2124-2128 (2019) Article DOI: 10.1016/j.bmcl.2019.06.062 BindingDB Entry DOI: 10.7270/Q23N26T3
					More data for this Ligand-Target Pair
Histone deacetylase 1 (Homo sapiens (Human))	BDBM50594396 (CHEMBL5172611) Show SMILES ONC(=O)c1ccc(CCN2CCN(CC2)C(c2ccccc2)c2ccccc2)cc1 Show InChI	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	4.80E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details Article DOI: 10.1021/acsmedchemlett.2c00081 BindingDB Entry DOI: 10.7270/Q2NG4VP5
					More data for this Ligand-Target Pair
Histone deacetylase 4 (Homo sapiens (Human))	BDBM50594398 (CHEMBL5175813) Show SMILES ONC(=O)c1ccc(CCCCN2CCN(CC2)C(c2ccccc2)c2ccccc2)cc1 Show InChI	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	5.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details Article DOI: 10.1021/acsmedchemlett.2c00081 BindingDB Entry DOI: 10.7270/Q2NG4VP5
					More data for this Ligand-Target Pair
Amine oxidase [flavin-containing] B (Homo sapiens (Human))	BDBM50593242 (CHEMBL5202250) Show SMILES COc1cc2CCN(Cc2cc1OC)c1cc(F)cc(F)c1 Show InChI	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	Purchase MCE PC cid PC sid UniChem	Article PubMed	n/a	n/a	5.10E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details Article DOI: 10.1021/acsmedchemlett.2c00228 BindingDB Entry DOI: 10.7270/Q2H70KTG
					More data for this Ligand-Target Pair
Histone deacetylase 1 (Homo sapiens (Human))	BDBM50594398 (CHEMBL5175813) Show SMILES ONC(=O)c1ccc(CCCCN2CCN(CC2)C(c2ccccc2)c2ccccc2)cc1 Show InChI	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	5.50E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details Article DOI: 10.1021/acsmedchemlett.2c00081 BindingDB Entry DOI: 10.7270/Q2NG4VP5
					More data for this Ligand-Target Pair
Histone deacetylase 6 (Mus musculus)	BDBM50594400 (CHEMBL5205202) Show SMILES ONC(=O)c1cccc(CN2CCN(CC2)C(c2ccccc2)c2ccccc2)c1 Show InChI	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	6.60E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details Article DOI: 10.1021/acsmedchemlett.2c00081 BindingDB Entry DOI: 10.7270/Q2NG4VP5
					More data for this Ligand-Target Pair
Histone deacetylase 1 (Homo sapiens (Human))	BDBM50594394 (CHEMBL5195750) Show SMILES CC(N1CCN(Cc2ccc(cc2)C(=O)NO)CC1)c1ccccc1 Show InChI	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase MCE PC cid PC sid UniChem	Article PubMed	n/a	n/a	6.70E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details Article DOI: 10.1021/acsmedchemlett.2c00081 BindingDB Entry DOI: 10.7270/Q2NG4VP5
					More data for this Ligand-Target Pair
Amine oxidase [flavin-containing] A (Homo sapiens (Human))	BDBM50513743 (CHEMBL4438605) Show SMILES COc1cc2CCN(CCCOc3ccc(C(C)=O)c(O)c3)Cc2cc1OC Show InChI InChI=1S/C22H27NO5/c1-15(24)19-6-5-18(13-20(19)25)28-10-4-8-23-9-7-16-11-21(26-2)22(27-3)12-17(16)14-23/h5-6,11-13,25H,4,7-10,14H2,1-3H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	8.10E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details Article DOI: 10.1021/acsmedchemlett.2c00228 BindingDB Entry DOI: 10.7270/Q2H70KTG
					More data for this Ligand-Target Pair
Histone deacetylase 4 (Homo sapiens (Human))	BDBM50594401 (CHEMBL5192796) Show SMILES ONC(=O)c1ccc(CN2CCN(Cc3ccccc3)CC2)cc1 Show InChI	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	9.20E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details Article DOI: 10.1021/acsmedchemlett.2c00081 BindingDB Entry DOI: 10.7270/Q2NG4VP5
					More data for this Ligand-Target Pair
Histone deacetylase 1 (Homo sapiens (Human))	BDBM50594401 (CHEMBL5192796) Show SMILES ONC(=O)c1ccc(CN2CCN(Cc3ccccc3)CC2)cc1 Show InChI	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.04E+4	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details Article DOI: 10.1021/acsmedchemlett.2c00081 BindingDB Entry DOI: 10.7270/Q2NG4VP5
					More data for this Ligand-Target Pair
Histone deacetylase 4 (Homo sapiens (Human))	BDBM50594394 (CHEMBL5195750) Show SMILES CC(N1CCN(Cc2ccc(cc2)C(=O)NO)CC1)c1ccccc1 Show InChI	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase MCE PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.23E+4	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details Article DOI: 10.1021/acsmedchemlett.2c00081 BindingDB Entry DOI: 10.7270/Q2NG4VP5
					More data for this Ligand-Target Pair
Amine oxidase [flavin-containing] B (Homo sapiens (Human))	BDBM50593241 (CHEMBL5188627) Show SMILES COc1cc2CCN(Cc2cc1OC)c1ccc(F)cc1 Show InChI	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	Purchase MCE PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.35E+4	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details Article DOI: 10.1021/acsmedchemlett.2c00228 BindingDB Entry DOI: 10.7270/Q2H70KTG
					More data for this Ligand-Target Pair
Amine oxidase [flavin-containing] B (Homo sapiens (Human))	BDBM50513743 (CHEMBL4438605) Show SMILES COc1cc2CCN(CCCOc3ccc(C(C)=O)c(O)c3)Cc2cc1OC Show InChI InChI=1S/C22H27NO5/c1-15(24)19-6-5-18(13-20(19)25)28-10-4-8-23-9-7-16-11-21(26-2)22(27-3)12-17(16)14-23/h5-6,11-13,25H,4,7-10,14H2,1-3H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.38E+4	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details Article DOI: 10.1021/acsmedchemlett.2c00228 BindingDB Entry DOI: 10.7270/Q2H70KTG
					More data for this Ligand-Target Pair
Histone deacetylase 1 (Homo sapiens (Human))	BDBM50594400 (CHEMBL5205202) Show SMILES ONC(=O)c1cccc(CN2CCN(CC2)C(c2ccccc2)c2ccccc2)c1 Show InChI	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	4.66E+4	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details Article DOI: 10.1021/acsmedchemlett.2c00081 BindingDB Entry DOI: 10.7270/Q2NG4VP5
					More data for this Ligand-Target Pair
Potassium voltage-gated channel subfamily H member 2 (Homo sapiens (Human))	BDBM50594401 (CHEMBL5192796) Show SMILES ONC(=O)c1ccc(CN2CCN(Cc3ccccc3)CC2)cc1 Show InChI	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	7.31E+4	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details Article DOI: 10.1021/acsmedchemlett.2c00081 BindingDB Entry DOI: 10.7270/Q2NG4VP5
					More data for this Ligand-Target Pair
Histone deacetylase 4 (Homo sapiens (Human))	BDBM50594400 (CHEMBL5205202) Show SMILES ONC(=O)c1cccc(CN2CCN(CC2)C(c2ccccc2)c2ccccc2)c1 Show InChI	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details Article DOI: 10.1021/acsmedchemlett.2c00081 BindingDB Entry DOI: 10.7270/Q2NG4VP5
					More data for this Ligand-Target Pair
Histone deacetylase 4 (Homo sapiens (Human))	BDBM50594399 (CHEMBL5198614) Show SMILES ONC(=O)c1ccccc1CN1CCN(CC1)C(c1ccccc1)c1ccccc1 Show InChI	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details Article DOI: 10.1021/acsmedchemlett.2c00081 BindingDB Entry DOI: 10.7270/Q2NG4VP5
					More data for this Ligand-Target Pair
Histone deacetylase 1 (Homo sapiens (Human))	BDBM50594399 (CHEMBL5198614) Show SMILES ONC(=O)c1ccccc1CN1CCN(CC1)C(c1ccccc1)c1ccccc1 Show InChI	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details Article DOI: 10.1021/acsmedchemlett.2c00081 BindingDB Entry DOI: 10.7270/Q2NG4VP5
					More data for this Ligand-Target Pair
Histone deacetylase 6 (Mus musculus)	BDBM50594399 (CHEMBL5198614) Show SMILES ONC(=O)c1ccccc1CN1CCN(CC1)C(c1ccccc1)c1ccccc1 Show InChI	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details Article DOI: 10.1021/acsmedchemlett.2c00081 BindingDB Entry DOI: 10.7270/Q2NG4VP5
					More data for this Ligand-Target Pair
Amine oxidase [flavin-containing] A (Homo sapiens (Human))	BDBM50593242 (CHEMBL5202250) Show SMILES COc1cc2CCN(Cc2cc1OC)c1cc(F)cc(F)c1 Show InChI	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	Purchase MCE PC cid PC sid UniChem	Article PubMed	n/a	n/a	>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details Article DOI: 10.1021/acsmedchemlett.2c00228 BindingDB Entry DOI: 10.7270/Q2H70KTG
					More data for this Ligand-Target Pair
Amine oxidase [flavin-containing] A (Mus musculus)	BDBM50593239 (CHEBI:5637 | CHEMBL12367 | EN300-17866) Show SMILES COc1cc2CCNCc2cc1OC Show InChI	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	Purchase PC cid PC sid UniChem	Article PubMed	n/a	n/a	>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details Article DOI: 10.1021/acsmedchemlett.2c00228 BindingDB Entry DOI: 10.7270/Q2H70KTG
					More data for this Ligand-Target Pair
Amine oxidase [flavin-containing] A (Homo sapiens (Human))	BDBM50593241 (CHEMBL5188627) Show SMILES COc1cc2CCN(Cc2cc1OC)c1ccc(F)cc1 Show InChI	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	Purchase MCE PC cid PC sid UniChem	Article PubMed	n/a	n/a	>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details Article DOI: 10.1021/acsmedchemlett.2c00228 BindingDB Entry DOI: 10.7270/Q2H70KTG
					More data for this Ligand-Target Pair
Amine oxidase [flavin-containing] A (Homo sapiens (Human))	BDBM50593240 (CHEMBL5199677) Show SMILES COc1cc2CCN(Cc2cc1OC)c1ccc(C=O)cc1 Show InChI	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	Purchase MCE PC cid PC sid UniChem	Article PubMed	n/a	n/a	>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details Article DOI: 10.1021/acsmedchemlett.2c00228 BindingDB Entry DOI: 10.7270/Q2H70KTG
					More data for this Ligand-Target Pair
Potassium voltage-gated channel subfamily H member 2 (Homo sapiens (Human))	BDBM50594394 (CHEMBL5195750) Show SMILES CC(N1CCN(Cc2ccc(cc2)C(=O)NO)CC1)c1ccccc1 Show InChI	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase MCE PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.06E+5	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details Article DOI: 10.1021/acsmedchemlett.2c00081 BindingDB Entry DOI: 10.7270/Q2NG4VP5
					More data for this Ligand-Target Pair
Amine oxidase [flavin-containing] B (Mus musculus)	BDBM50593239 (CHEBI:5637 | CHEMBL12367 | EN300-17866) Show SMILES COc1cc2CCNCc2cc1OC Show InChI	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	Purchase PC cid PC sid UniChem	Article PubMed	n/a	n/a	>1.00E+6	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details Article DOI: 10.1021/acsmedchemlett.2c00228 BindingDB Entry DOI: 10.7270/Q2H70KTG
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha (Homo sapiens (Human))	BDBM50521955 (CHEMBL4468865) Show SMILES CC(C)c1nn(-c2ccc(F)cc2)c2nc(C)cc(C(O)=O)c12 Show InChI InChI=1S/C17H16FN3O2/c1-9(2)15-14-13(17(22)23)8-10(3)19-16(14)21(20-15)12-6-4-11(18)5-7-12/h4-9H,1-3H3,(H,22,23)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	Purchase PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	2.06E+3	n/a	n/a	n/a	n/a
Okayama University Curated by ChEMBL					Assay Description Transactivation of human GAL4-fused PPARalpha LBD expressed in human HepG2 cells after 24 hrs by renilla luciferase reporter gene assay				Bioorg Med Chem Lett 29: 2124-2128 (2019) Article DOI: 10.1016/j.bmcl.2019.06.062 BindingDB Entry DOI: 10.7270/Q23N26T3
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha (Homo sapiens (Human))	BDBM50521956 (CHEMBL4549332) Show SMILES CC(C)c1nn(-c2ccc(Cl)cc2)c2nc(cc(C(O)=O)c12)-c1ccccc1 Show InChI InChI=1S/C22H18ClN3O2/c1-13(2)20-19-17(22(27)28)12-18(14-6-4-3-5-7-14)24-21(19)26(25-20)16-10-8-15(23)9-11-16/h3-13H,1-2H3,(H,27,28)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	1.80E+3	n/a	n/a	n/a	n/a
Okayama University Curated by ChEMBL					Assay Description Transactivation of human GAL4-fused PPARalpha LBD expressed in human HepG2 cells after 24 hrs by renilla luciferase reporter gene assay				Bioorg Med Chem Lett 29: 2124-2128 (2019) Article DOI: 10.1016/j.bmcl.2019.06.062 BindingDB Entry DOI: 10.7270/Q23N26T3
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha (Homo sapiens (Human))	BDBM50521957 (CHEMBL4457812) Show SMILES CCC(C)c1nn(-c2ccc(Cl)cc2)c2nc(C)cc(C(O)=O)c12 Show InChI InChI=1S/C18H18ClN3O2/c1-4-10(2)16-15-14(18(23)24)9-11(3)20-17(15)22(21-16)13-7-5-12(19)6-8-13/h5-10H,4H2,1-3H3,(H,23,24)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	680	n/a	n/a	n/a	n/a
Okayama University Curated by ChEMBL					Assay Description Transactivation of human GAL4-fused PPARalpha LBD expressed in human HepG2 cells after 24 hrs by renilla luciferase reporter gene assay				Bioorg Med Chem Lett 29: 2124-2128 (2019) Article DOI: 10.1016/j.bmcl.2019.06.062 BindingDB Entry DOI: 10.7270/Q23N26T3
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha (Homo sapiens (Human))	BDBM50521958 (CHEMBL4440299) Show SMILES CCC(CC)c1nn(-c2ccc(F)cc2)c2nc(CC)cc(C(O)=O)c12 Show InChI InChI=1S/C20H22FN3O2/c1-4-12(5-2)18-17-16(20(25)26)11-14(6-3)22-19(17)24(23-18)15-9-7-13(21)8-10-15/h7-12H,4-6H2,1-3H3,(H,25,26)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid PDB UniChem	PDB Article PubMed	n/a	n/a	n/a	n/a	1.53E+3	n/a	n/a	n/a	n/a
Okayama University Curated by ChEMBL					Assay Description Transactivation of human GAL4-fused PPARalpha LBD expressed in human HepG2 cells after 24 hrs by renilla luciferase reporter gene assay				Bioorg Med Chem Lett 29: 2124-2128 (2019) Article DOI: 10.1016/j.bmcl.2019.06.062 BindingDB Entry DOI: 10.7270/Q23N26T3
					More data for this Ligand-Target Pair				3D Structure (crystal)
Peroxisome proliferator-activated receptor alpha (Homo sapiens (Human))	BDBM50521959 (CHEMBL4534481) Show SMILES CCC(CC)c1nn(-c2ccc(Cl)cc2)c2nc(C)cc(C(O)=O)c12 Show InChI InChI=1S/C19H20ClN3O2/c1-4-12(5-2)17-16-15(19(24)25)10-11(3)21-18(16)23(22-17)14-8-6-13(20)7-9-14/h6-10,12H,4-5H2,1-3H3,(H,24,25)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	>3.57E+3	n/a	n/a	n/a	n/a
Okayama University Curated by ChEMBL					Assay Description Transactivation of human GAL4-fused PPARalpha LBD expressed in human HepG2 cells after 24 hrs by renilla luciferase reporter gene assay				Bioorg Med Chem Lett 29: 2124-2128 (2019) Article DOI: 10.1016/j.bmcl.2019.06.062 BindingDB Entry DOI: 10.7270/Q23N26T3
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha (Mus musculus)	BDBM50521948 (CHEMBL4454999) Show SMILES CC(C)c1nn(-c2ccc(Cl)cc2)c2nc(C)cc(C(O)=O)c12 Show InChI InChI=1S/C17H16ClN3O2/c1-9(2)15-14-13(17(22)23)8-10(3)19-16(14)21(20-15)12-6-4-11(18)5-7-12/h4-9H,1-3H3,(H,22,23)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid PDB UniChem	PDB Article PubMed	n/a	n/a	n/a	n/a	1.13E+4	n/a	n/a	n/a	n/a
Okayama University Curated by ChEMBL					Assay Description Transactivation of mouse GAL4-fused PPARalpha expressed in human HepG2 cells after 24 hrs by dual renilla-luciferase reporter gene assay				Bioorg Med Chem Lett 29: 2124-2128 (2019) Article DOI: 10.1016/j.bmcl.2019.06.062 BindingDB Entry DOI: 10.7270/Q23N26T3
					More data for this Ligand-Target Pair				3D Structure (crystal)
Peroxisome proliferator-activated receptor alpha (Rattus norvegicus)	BDBM50521948 (CHEMBL4454999) Show SMILES CC(C)c1nn(-c2ccc(Cl)cc2)c2nc(C)cc(C(O)=O)c12 Show InChI InChI=1S/C17H16ClN3O2/c1-9(2)15-14-13(17(22)23)8-10(3)19-16(14)21(20-15)12-6-4-11(18)5-7-12/h4-9H,1-3H3,(H,22,23)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid PDB UniChem	PDB Article PubMed	n/a	n/a	n/a	n/a	1.59E+4	n/a	n/a	n/a	n/a
Okayama University Curated by ChEMBL					Assay Description Transactivation of rat GAL4-fused PPARalpha expressed in human HepG2 cells after 24 hrs by dual renilla-luciferase reporter gene assay				Bioorg Med Chem Lett 29: 2124-2128 (2019) Article DOI: 10.1016/j.bmcl.2019.06.062 BindingDB Entry DOI: 10.7270/Q23N26T3
					More data for this Ligand-Target Pair				3D Structure (crystal)
Peroxisome proliferator-activated receptor alpha (Homo sapiens (Human))	BDBM50085042 (2-(4-(4-Chlorobenzoyl)phenoxy)-2-methylpropanoic a...) Show SMILES CC(C)OC(=O)C(C)(C)Oc1ccc(cc1)C(=O)c1ccc(Cl)cc1 Show InChI InChI=1S/C20H21ClO4/c1-13(2)24-19(23)20(3,4)25-17-11-7-15(8-12-17)18(22)14-5-9-16(21)10-6-14/h5-13H,1-4H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	Purchase CHEMBL DrugBank MCE KEGG PC cid PC sid PDB UniChem Patents Similars	Article PubMed	n/a	n/a	n/a	n/a	5.00E+4	n/a	n/a	n/a	n/a
Okayama University Curated by ChEMBL					Assay Description Transactivation of human GAL4-fused PPARalpha LBD expressed in human HepG2 cells after 24 hrs by renilla luciferase reporter gene assay				Bioorg Med Chem Lett 29: 2124-2128 (2019) Article DOI: 10.1016/j.bmcl.2019.06.062 BindingDB Entry DOI: 10.7270/Q23N26T3
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha (Homo sapiens (Human))	BDBM50521960 (CHEMBL4538761) Show SMILES CC(C)c1nn(-c2ccc(Br)cc2)c2nc(C)cc(C(O)=O)c12 Show InChI InChI=1S/C17H16BrN3O2/c1-9(2)15-14-13(17(22)23)8-10(3)19-16(14)21(20-15)12-6-4-11(18)5-7-12/h4-9H,1-3H3,(H,22,23)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	>4.01E+3	n/a	n/a	n/a	n/a
Okayama University Curated by ChEMBL					Assay Description Transactivation of human GAL4-fused PPARalpha LBD expressed in human HepG2 cells after 24 hrs by renilla luciferase reporter gene assay				Bioorg Med Chem Lett 29: 2124-2128 (2019) Article DOI: 10.1016/j.bmcl.2019.06.062 BindingDB Entry DOI: 10.7270/Q23N26T3
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha (Homo sapiens (Human))	BDBM50521961 (CHEMBL4548269) Show SMILES CC(C)c1nn(-c2ccc(I)cc2)c2nc(C)cc(C(O)=O)c12 Show InChI InChI=1S/C17H16IN3O2/c1-9(2)15-14-13(17(22)23)8-10(3)19-16(14)21(20-15)12-6-4-11(18)5-7-12/h4-9H,1-3H3,(H,22,23)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	2.41E+3	n/a	n/a	n/a	n/a
Okayama University Curated by ChEMBL					Assay Description Transactivation of human GAL4-fused PPARalpha LBD expressed in human HepG2 cells after 24 hrs by renilla luciferase reporter gene assay				Bioorg Med Chem Lett 29: 2124-2128 (2019) Article DOI: 10.1016/j.bmcl.2019.06.062 BindingDB Entry DOI: 10.7270/Q23N26T3
					More data for this Ligand-Target Pair

Displayed 1 to 50 (of 65 total )  |  Next  |  Last  >>

Jump to: