Compile Data Set for Download or QSAR

Found 70 hits with Last Name = 'mcclure' and Initial = 'jj'   

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
Histone deacetylase 3 (Homo sapiens (Human))	BDBM476626 (N-(4-(2-propylhydrazine-1- carbonyl)benzyl)cinnama...) Show SMILES CCCNNC(=O)c1ccc(CNC(=O)\C=C\c2ccccc2)cc1 Show InChI InChI=1S/C20H23N3O2/c1-2-14-22-23-20(25)18-11-8-17(9-12-18)15-21-19(24)13-10-16-6-4-3-5-7-16/h3-13,22H,2,14-15H2,1H3,(H,21,24)(H,23,25)/b13-10+	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase MCE PC cid PC sid UniChem	PubMed	n/a	n/a	0.950	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Allosteric inhibition of C-terminal His-tagged recombinant human HDAC3 expressed in Sf9 cells pre-incubated for 2 hrs before acetylated lysine-aminom...				Citation and Details BindingDB Entry DOI: 10.7270/Q2H70KFJ
					More data for this Ligand-Target Pair
Histone deacetylase 3 (Homo sapiens (Human))	BDBM476611 (N-(4-(2-propylhydrazine-1- carbonyl)benzyl)benzami...) Show SMILES CCCNNC(=O)c1ccc(CNC(=O)c2ccccc2)cc1 Show InChI InChI=1S/C18H21N3O2/c1-2-12-20-21-18(23)16-10-8-14(9-11-16)13-19-17(22)15-6-4-3-5-7-15/h3-11,20H,2,12-13H2,1H3,(H,19,22)(H,21,23)	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	PubMed	n/a	n/a	3.5	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Allosteric inhibition of C-terminal His-tagged recombinant human HDAC3 expressed in Sf9 cells pre-incubated for 2 hrs before acetylated lysine-aminom...				Citation and Details BindingDB Entry DOI: 10.7270/Q2H70KFJ
					More data for this Ligand-Target Pair
Histone deacetylase 3 (Homo sapiens (Human))	BDBM476627 (N-(4-(2-butylhydrazine-1- carbonyl)benzyl)cinnamam...) Show SMILES CCCCNNC(=O)c1ccc(CNC(=O)\C=C\c2ccccc2)cc1 Show InChI InChI=1S/C21H25N3O2/c1-2-3-15-23-24-21(26)19-12-9-18(10-13-19)16-22-20(25)14-11-17-7-5-4-6-8-17/h4-14,23H,2-3,15-16H2,1H3,(H,22,25)(H,24,26)/b14-11+	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	PubMed	n/a	n/a	3.70	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Allosteric inhibition of C-terminal His-tagged recombinant human HDAC3 expressed in Sf9 cells pre-incubated for 2 hrs before acetylated lysine-aminom...				Citation and Details BindingDB Entry DOI: 10.7270/Q2H70KFJ
					More data for this Ligand-Target Pair
Histone deacetylase 3 (Homo sapiens (Human))	BDBM476606 (N-(4-(2-butylhydrazine-1- carbonyl)benzyl)benzamid...) Show SMILES CCCCNNC(=O)c1ccc(CNC(=O)c2ccccc2)cc1 Show InChI InChI=1S/C19H23N3O2/c1-2-3-13-21-22-19(24)17-11-9-15(10-12-17)14-20-18(23)16-7-5-4-6-8-16/h4-12,21H,2-3,13-14H2,1H3,(H,20,23)(H,22,24)	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	PubMed	n/a	n/a	8.60	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Allosteric inhibition of C-terminal His-tagged recombinant human HDAC3 expressed in Sf9 cells pre-incubated for 2 hrs before acetylated lysine-aminom...				Citation and Details BindingDB Entry DOI: 10.7270/Q2H70KFJ
					More data for this Ligand-Target Pair
Histone deacetylase 1 (Homo sapiens (Human))	BDBM476626 (N-(4-(2-propylhydrazine-1- carbonyl)benzyl)cinnama...) Show SMILES CCCNNC(=O)c1ccc(CNC(=O)\C=C\c2ccccc2)cc1 Show InChI InChI=1S/C20H23N3O2/c1-2-14-22-23-20(25)18-11-8-17(9-12-18)15-21-19(24)13-10-16-6-4-3-5-7-16/h3-13,22H,2,14-15H2,1H3,(H,21,24)(H,23,25)/b13-10+	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase MCE PC cid PC sid UniChem	PubMed	n/a	n/a	12	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of C-terminal His-tagged recombinant human HDAC1 expressed in Sf9 cells pre-incubated for 2 hrs before acetylated lysine-aminomethyl couma...				Citation and Details BindingDB Entry DOI: 10.7270/Q2H70KFJ
					More data for this Ligand-Target Pair
Histone deacetylase 3 (Homo sapiens (Human))	BDBM476613 (N-(4-(2-pentylhydrazine-1- carbonyl)benzyl)benzami...) Show SMILES CCCCCNNC(=O)c1ccc(CNC(=O)c2ccccc2)cc1 Show InChI InChI=1S/C20H25N3O2/c1-2-3-7-14-22-23-20(25)18-12-10-16(11-13-18)15-21-19(24)17-8-5-4-6-9-17/h4-6,8-13,22H,2-3,7,14-15H2,1H3,(H,21,24)(H,23,25)	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	PubMed	n/a	n/a	19	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Allosteric inhibition of C-terminal His-tagged recombinant human HDAC3 expressed in Sf9 cells pre-incubated for 2 hrs before acetylated lysine-aminom...				Citation and Details BindingDB Entry DOI: 10.7270/Q2H70KFJ
					More data for this Ligand-Target Pair
Histone deacetylase 3 (Homo sapiens (Human))	BDBM476625 (N-(4-(2-ethylhydrazine-1- carbonyl)benzyl)cinnamam...) Show SMILES CCNNC(=O)c1ccc(CNC(=O)\C=C\c2ccccc2)cc1 Show InChI InChI=1S/C19H21N3O2/c1-2-21-22-19(24)17-11-8-16(9-12-17)14-20-18(23)13-10-15-6-4-3-5-7-15/h3-13,21H,2,14H2,1H3,(H,20,23)(H,22,24)/b13-10+	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	PubMed	n/a	n/a	20	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Allosteric inhibition of C-terminal His-tagged recombinant human HDAC3 expressed in Sf9 cells pre-incubated for 2 hrs before acetylated lysine-aminom...				Citation and Details BindingDB Entry DOI: 10.7270/Q2H70KFJ
					More data for this Ligand-Target Pair
Histone deacetylase 1 (Homo sapiens (Human))	BDBM476625 (N-(4-(2-ethylhydrazine-1- carbonyl)benzyl)cinnamam...) Show SMILES CCNNC(=O)c1ccc(CNC(=O)\C=C\c2ccccc2)cc1 Show InChI InChI=1S/C19H21N3O2/c1-2-21-22-19(24)17-11-8-16(9-12-17)14-20-18(23)13-10-15-6-4-3-5-7-15/h3-13,21H,2,14H2,1H3,(H,20,23)(H,22,24)/b13-10+	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	PubMed	n/a	n/a	29	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of C-terminal His-tagged recombinant human HDAC1 expressed in Sf9 cells pre-incubated for 2 hrs before acetylated lysine-aminomethyl couma...				Citation and Details BindingDB Entry DOI: 10.7270/Q2H70KFJ
					More data for this Ligand-Target Pair
Histone deacetylase 3 (Homo sapiens (Human))	BDBM476629 (N-(4-(2-pentylhydrazine-1- carbonyl)benzyl)cinnama...) Show SMILES CCCCCNNC(=O)c1ccc(CNC(=O)\C=C\c2ccccc2)cc1 Show InChI InChI=1S/C22H27N3O2/c1-2-3-7-16-24-25-22(27)20-13-10-19(11-14-20)17-23-21(26)15-12-18-8-5-4-6-9-18/h4-6,8-15,24H,2-3,7,16-17H2,1H3,(H,23,26)(H,25,27)/b15-12+	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	PubMed	n/a	n/a	33	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Allosteric inhibition of C-terminal His-tagged recombinant human HDAC3 expressed in Sf9 cells pre-incubated for 2 hrs before acetylated lysine-aminom...				Citation and Details BindingDB Entry DOI: 10.7270/Q2H70KFJ
					More data for this Ligand-Target Pair
Histone deacetylase 3 (Homo sapiens (Human))	BDBM476615 (N-(4-(2- (cyclopropylmethyl)hydrazine- 1-carbonyl)...) Show SMILES O=C(NCc1ccc(cc1)C(=O)NNCC1CC1)c1ccccc1 Show InChI InChI=1S/C19H21N3O2/c23-18(16-4-2-1-3-5-16)20-12-14-8-10-17(11-9-14)19(24)22-21-13-15-6-7-15/h1-5,8-11,15,21H,6-7,12-13H2,(H,20,23)(H,22,24)	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	PubMed	n/a	n/a	40	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Allosteric inhibition of C-terminal His-tagged recombinant human HDAC3 expressed in Sf9 cells pre-incubated for 2 hrs before acetylated lysine-aminom...				Citation and Details BindingDB Entry DOI: 10.7270/Q2H70KFJ
					More data for this Ligand-Target Pair
Histone deacetylase 1 (Homo sapiens (Human))	BDBM476629 (N-(4-(2-pentylhydrazine-1- carbonyl)benzyl)cinnama...) Show SMILES CCCCCNNC(=O)c1ccc(CNC(=O)\C=C\c2ccccc2)cc1 Show InChI InChI=1S/C22H27N3O2/c1-2-3-7-16-24-25-22(27)20-13-10-19(11-14-20)17-23-21(26)15-12-18-8-5-4-6-9-18/h4-6,8-15,24H,2-3,7,16-17H2,1H3,(H,23,26)(H,25,27)/b15-12+	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	PubMed	n/a	n/a	47	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of C-terminal His-tagged recombinant human HDAC1 expressed in Sf9 cells pre-incubated for 2 hrs before acetylated lysine-aminomethyl couma...				Citation and Details BindingDB Entry DOI: 10.7270/Q2H70KFJ
					More data for this Ligand-Target Pair
Histone deacetylase 1 (Homo sapiens (Human))	BDBM476627 (N-(4-(2-butylhydrazine-1- carbonyl)benzyl)cinnamam...) Show SMILES CCCCNNC(=O)c1ccc(CNC(=O)\C=C\c2ccccc2)cc1 Show InChI InChI=1S/C21H25N3O2/c1-2-3-15-23-24-21(26)19-12-9-18(10-13-19)16-22-20(25)14-11-17-7-5-4-6-8-17/h4-14,23H,2-3,15-16H2,1H3,(H,22,25)(H,24,26)/b14-11+	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	PubMed	n/a	n/a	60	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of C-terminal His-tagged recombinant human HDAC1 expressed in Sf9 cells pre-incubated for 2 hrs before acetylated lysine-aminomethyl couma...				Citation and Details BindingDB Entry DOI: 10.7270/Q2H70KFJ
					More data for this Ligand-Target Pair
Histone deacetylase 3 (Homo sapiens (Human))	BDBM476614 (N-(4-(2-(3,3,3- trifluoropropyl)hydrazine-1- carbo...) Show SMILES FC(F)(F)CCNNC(=O)c1ccc(CNC(=O)c2ccccc2)cc1 Show InChI InChI=1S/C18H18F3N3O2/c19-18(20,21)10-11-23-24-17(26)15-8-6-13(7-9-15)12-22-16(25)14-4-2-1-3-5-14/h1-9,23H,10-12H2,(H,22,25)(H,24,26)	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	PubMed	n/a	n/a	69	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Allosteric inhibition of C-terminal His-tagged recombinant human HDAC3 expressed in Sf9 cells pre-incubated for 2 hrs before acetylated lysine-aminom...				Citation and Details BindingDB Entry DOI: 10.7270/Q2H70KFJ
					More data for this Ligand-Target Pair
Histone deacetylase 3 (Homo sapiens (Human))	BDBM468609 (US10807944, Compound RLS3-43 | US10870618, Compoun...) Show SMILES CCCCNNC(=O)c1ccc(cc1)-c1ccccc1 Show InChI InChI=1S/C17H20N2O/c1-2-3-13-18-19-17(20)16-11-9-15(10-12-16)14-7-5-4-6-8-14/h4-12,18H,2-3,13H2,1H3,(H,19,20)	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	PubMed	n/a	n/a	69	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Allosteric inhibition of C-terminal His-tagged recombinant human HDAC3 expressed in Sf9 cells pre-incubated for 2 hrs before acetylated lysine-aminom...				Citation and Details BindingDB Entry DOI: 10.7270/Q2H70KFJ
					More data for this Ligand-Target Pair
Histone deacetylase 2 (Homo sapiens (Human))	BDBM476627 (N-(4-(2-butylhydrazine-1- carbonyl)benzyl)cinnamam...) Show SMILES CCCCNNC(=O)c1ccc(CNC(=O)\C=C\c2ccccc2)cc1 Show InChI InChI=1S/C21H25N3O2/c1-2-3-15-23-24-21(26)19-12-9-18(10-13-19)16-22-20(25)14-11-17-7-5-4-6-8-17/h4-14,23H,2-3,15-16H2,1H3,(H,22,25)(H,24,26)/b14-11+	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	PubMed	n/a	n/a	70	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of C-terminal His-tagged recombinant human HDAC2 expressed in Sf9 cells pre-incubated for 2 hrs before acetylated lysine-aminomethyl couma...				Citation and Details BindingDB Entry DOI: 10.7270/Q2H70KFJ
					More data for this Ligand-Target Pair
Histone deacetylase 2 (Homo sapiens (Human))	BDBM476625 (N-(4-(2-ethylhydrazine-1- carbonyl)benzyl)cinnamam...) Show SMILES CCNNC(=O)c1ccc(CNC(=O)\C=C\c2ccccc2)cc1 Show InChI InChI=1S/C19H21N3O2/c1-2-21-22-19(24)17-11-8-16(9-12-17)14-20-18(23)13-10-15-6-4-3-5-7-15/h3-13,21H,2,14H2,1H3,(H,20,23)(H,22,24)/b13-10+	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	PubMed	n/a	n/a	77	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of C-terminal His-tagged recombinant human HDAC2 expressed in Sf9 cells pre-incubated for 2 hrs before acetylated lysine-aminomethyl couma...				Citation and Details BindingDB Entry DOI: 10.7270/Q2H70KFJ
					More data for this Ligand-Target Pair
Histone deacetylase 1 (Homo sapiens (Human))	BDBM476630 (N-(4-(2-hexylhydrazine-1- carbonyl)benzyl)cinnamam...) Show SMILES CCCCCCNNC(=O)c1ccc(CNC(=O)\C=C\c2ccccc2)cc1 Show InChI InChI=1S/C23H29N3O2/c1-2-3-4-8-17-25-26-23(28)21-14-11-20(12-15-21)18-24-22(27)16-13-19-9-6-5-7-10-19/h5-7,9-16,25H,2-4,8,17-18H2,1H3,(H,24,27)(H,26,28)/b16-13+	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	PubMed	n/a	n/a	81	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of C-terminal His-tagged recombinant human HDAC1 expressed in Sf9 cells pre-incubated for 2 hrs before acetylated lysine-aminomethyl couma...				Citation and Details BindingDB Entry DOI: 10.7270/Q2H70KFJ
					More data for this Ligand-Target Pair
Histone deacetylase 3 (Homo sapiens (Human))	BDBM476623 (N-(4-(2- (cyclobutylmethyl)hydrazine- 1-carbonyl)b...) Show SMILES O=C(NCc1ccc(cc1)C(=O)NNCC1CCC1)c1ccccc1 Show InChI InChI=1S/C20H23N3O2/c24-19(17-7-2-1-3-8-17)21-13-16-9-11-18(12-10-16)20(25)23-22-14-15-5-4-6-15/h1-3,7-12,15,22H,4-6,13-14H2,(H,21,24)(H,23,25)	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	PubMed	n/a	n/a	84	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Allosteric inhibition of C-terminal His-tagged recombinant human HDAC3 expressed in Sf9 cells pre-incubated for 2 hrs before acetylated lysine-aminom...				Citation and Details BindingDB Entry DOI: 10.7270/Q2H70KFJ
					More data for this Ligand-Target Pair
Histone deacetylase 2 (Homo sapiens (Human))	BDBM476626 (N-(4-(2-propylhydrazine-1- carbonyl)benzyl)cinnama...) Show SMILES CCCNNC(=O)c1ccc(CNC(=O)\C=C\c2ccccc2)cc1 Show InChI InChI=1S/C20H23N3O2/c1-2-14-22-23-20(25)18-11-8-17(9-12-18)15-21-19(24)13-10-16-6-4-3-5-7-16/h3-13,22H,2,14-15H2,1H3,(H,21,24)(H,23,25)/b13-10+	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase MCE PC cid PC sid UniChem	PubMed	n/a	n/a	95	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of C-terminal His-tagged recombinant human HDAC2 expressed in Sf9 cells pre-incubated for 2 hrs before acetylated lysine-aminomethyl couma...				Citation and Details BindingDB Entry DOI: 10.7270/Q2H70KFJ
					More data for this Ligand-Target Pair
Histone deacetylase 2 (Homo sapiens (Human))	BDBM476629 (N-(4-(2-pentylhydrazine-1- carbonyl)benzyl)cinnama...) Show SMILES CCCCCNNC(=O)c1ccc(CNC(=O)\C=C\c2ccccc2)cc1 Show InChI InChI=1S/C22H27N3O2/c1-2-3-7-16-24-25-22(27)20-13-10-19(11-14-20)17-23-21(26)15-12-18-8-5-4-6-9-18/h4-6,8-15,24H,2-3,7,16-17H2,1H3,(H,23,26)(H,25,27)/b15-12+	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	PubMed	n/a	n/a	100	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of C-terminal His-tagged recombinant human HDAC2 expressed in Sf9 cells pre-incubated for 2 hrs before acetylated lysine-aminomethyl couma...				Citation and Details BindingDB Entry DOI: 10.7270/Q2H70KFJ
					More data for this Ligand-Target Pair
Histone deacetylase 3 (Homo sapiens (Human))	BDBM476626 (N-(4-(2-propylhydrazine-1- carbonyl)benzyl)cinnama...) Show SMILES CCCNNC(=O)c1ccc(CNC(=O)\C=C\c2ccccc2)cc1 Show InChI InChI=1S/C20H23N3O2/c1-2-14-22-23-20(25)18-11-8-17(9-12-18)15-21-19(24)13-10-16-6-4-3-5-7-16/h3-13,22H,2,14-15H2,1H3,(H,21,24)(H,23,25)/b13-10+	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase MCE PC cid PC sid UniChem	PubMed	n/a	n/a	124	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Allosteric inhibition of HDAC3 in HEK293 cell lysates pre-incubated for 2 hrs before acetylated lysine-aminomethyl coumarin-BOC addition and measured...				Citation and Details BindingDB Entry DOI: 10.7270/Q2H70KFJ
					More data for this Ligand-Target Pair
Histone deacetylase 2 (Homo sapiens (Human))	BDBM476630 (N-(4-(2-hexylhydrazine-1- carbonyl)benzyl)cinnamam...) Show SMILES CCCCCCNNC(=O)c1ccc(CNC(=O)\C=C\c2ccccc2)cc1 Show InChI InChI=1S/C23H29N3O2/c1-2-3-4-8-17-25-26-23(28)21-14-11-20(12-15-21)18-24-22(27)16-13-19-9-6-5-7-10-19/h5-7,9-16,25H,2-4,8,17-18H2,1H3,(H,24,27)(H,26,28)/b16-13+	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	PubMed	n/a	n/a	139	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of C-terminal His-tagged recombinant human HDAC2 expressed in Sf9 cells pre-incubated for 2 hrs before acetylated lysine-aminomethyl couma...				Citation and Details BindingDB Entry DOI: 10.7270/Q2H70KFJ
					More data for this Ligand-Target Pair
Histone deacetylase 3 (Homo sapiens (Human))	BDBM476630 (N-(4-(2-hexylhydrazine-1- carbonyl)benzyl)cinnamam...) Show SMILES CCCCCCNNC(=O)c1ccc(CNC(=O)\C=C\c2ccccc2)cc1 Show InChI InChI=1S/C23H29N3O2/c1-2-3-4-8-17-25-26-23(28)21-14-11-20(12-15-21)18-24-22(27)16-13-19-9-6-5-7-10-19/h5-7,9-16,25H,2-4,8,17-18H2,1H3,(H,24,27)(H,26,28)/b16-13+	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	PubMed	n/a	n/a	150	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Allosteric inhibition of C-terminal His-tagged recombinant human HDAC3 expressed in Sf9 cells pre-incubated for 2 hrs before acetylated lysine-aminom...				Citation and Details BindingDB Entry DOI: 10.7270/Q2H70KFJ
					More data for this Ligand-Target Pair
Histone deacetylase 3 (Homo sapiens (Human))	BDBM476611 (N-(4-(2-propylhydrazine-1- carbonyl)benzyl)benzami...) Show SMILES CCCNNC(=O)c1ccc(CNC(=O)c2ccccc2)cc1 Show InChI InChI=1S/C18H21N3O2/c1-2-12-20-21-18(23)16-10-8-14(9-11-16)13-19-17(22)15-6-4-3-5-7-15/h3-11,20H,2,12-13H2,1H3,(H,19,22)(H,21,23)	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	PubMed	n/a	n/a	155	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Allosteric inhibition of HDAC3 in HEK293 cell lysates pre-incubated for 2 hrs before acetylated lysine-aminomethyl coumarin-BOC addition and measured...				Citation and Details BindingDB Entry DOI: 10.7270/Q2H70KFJ
					More data for this Ligand-Target Pair
Histone deacetylase 3 (Homo sapiens (Human))	BDBM163623 (SR-3206 | US10807944, Compound RLS2-126 | US108706...) Show SMILES CCCCNNC(=O)c1ccc(OC)cc1 Show InChI InChI=1S/C12H18N2O2/c1-3-4-9-13-14-12(15)10-5-7-11(16-2)8-6-10/h5-8,13H,3-4,9H2,1-2H3,(H,14,15)	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	PubMed	n/a	n/a	157	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Allosteric inhibition of C-terminal His-tagged recombinant human HDAC3 expressed in Sf9 cells pre-incubated for 2 hrs before acetylated lysine-aminom...				Citation and Details BindingDB Entry DOI: 10.7270/Q2H70KFJ
					More data for this Ligand-Target Pair
Histone deacetylase 3 (Homo sapiens (Human))	BDBM476625 (N-(4-(2-ethylhydrazine-1- carbonyl)benzyl)cinnamam...) Show SMILES CCNNC(=O)c1ccc(CNC(=O)\C=C\c2ccccc2)cc1 Show InChI InChI=1S/C19H21N3O2/c1-2-21-22-19(24)17-11-8-16(9-12-17)14-20-18(23)13-10-15-6-4-3-5-7-15/h3-13,21H,2,14H2,1H3,(H,20,23)(H,22,24)/b13-10+	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	PubMed	n/a	n/a	171	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Allosteric inhibition of HDAC3 in HEK293 cell lysates pre-incubated for 2 hrs before acetylated lysine-aminomethyl coumarin-BOC addition and measured...				Citation and Details BindingDB Entry DOI: 10.7270/Q2H70KFJ
					More data for this Ligand-Target Pair
Histone deacetylase 3 (Homo sapiens (Human))	BDBM476619 (N-(4-(2-hexylhydrazine-1- carbonyl)benzyl)benzamid...) Show SMILES CCCCCCNNC(=O)c1ccc(CNC(=O)c2ccccc2)cc1 Show InChI InChI=1S/C21H27N3O2/c1-2-3-4-8-15-23-24-21(26)19-13-11-17(12-14-19)16-22-20(25)18-9-6-5-7-10-18/h5-7,9-14,23H,2-4,8,15-16H2,1H3,(H,22,25)(H,24,26)	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	PubMed	n/a	n/a	184	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Allosteric inhibition of C-terminal His-tagged recombinant human HDAC3 expressed in Sf9 cells pre-incubated for 2 hrs before acetylated lysine-aminom...				Citation and Details BindingDB Entry DOI: 10.7270/Q2H70KFJ
					More data for this Ligand-Target Pair
Histone deacetylase 3 (Homo sapiens (Human))	BDBM476622 (N-(4-(2-ethylhydrazine-1- carbonyl)benzyl)benzamid...) Show SMILES CCNNC(=O)c1ccc(CNC(=O)c2ccccc2)cc1 Show InChI InChI=1S/C17H19N3O2/c1-2-19-20-17(22)15-10-8-13(9-11-15)12-18-16(21)14-6-4-3-5-7-14/h3-11,19H,2,12H2,1H3,(H,18,21)(H,20,22)	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	PubMed	n/a	n/a	187	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Allosteric inhibition of C-terminal His-tagged recombinant human HDAC3 expressed in Sf9 cells pre-incubated for 2 hrs before acetylated lysine-aminom...				Citation and Details BindingDB Entry DOI: 10.7270/Q2H70KFJ
					More data for this Ligand-Target Pair
Histone deacetylase 3 (Homo sapiens (Human))	BDBM476606 (N-(4-(2-butylhydrazine-1- carbonyl)benzyl)benzamid...) Show SMILES CCCCNNC(=O)c1ccc(CNC(=O)c2ccccc2)cc1 Show InChI InChI=1S/C19H23N3O2/c1-2-3-13-21-22-19(24)17-11-9-15(10-12-17)14-20-18(23)16-7-5-4-6-8-16/h4-12,21H,2-3,13-14H2,1H3,(H,20,23)(H,22,24)	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	PubMed	n/a	n/a	261	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Allosteric inhibition of HDAC3 in HEK293 cell lysates pre-incubated for 2 hrs before acetylated lysine-aminomethyl coumarin-BOC addition and measured...				Citation and Details BindingDB Entry DOI: 10.7270/Q2H70KFJ
					More data for this Ligand-Target Pair
Histone deacetylase 3 (Homo sapiens (Human))	BDBM476613 (N-(4-(2-pentylhydrazine-1- carbonyl)benzyl)benzami...) Show SMILES CCCCCNNC(=O)c1ccc(CNC(=O)c2ccccc2)cc1 Show InChI InChI=1S/C20H25N3O2/c1-2-3-7-14-22-23-20(25)18-12-10-16(11-13-18)15-21-19(24)17-8-5-4-6-9-17/h4-6,8-13,22H,2-3,7,14-15H2,1H3,(H,21,24)(H,23,25)	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	PubMed	n/a	n/a	264	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Allosteric inhibition of HDAC3 in HEK293 cell lysates pre-incubated for 2 hrs before acetylated lysine-aminomethyl coumarin-BOC addition and measured...				Citation and Details BindingDB Entry DOI: 10.7270/Q2H70KFJ
					More data for this Ligand-Target Pair
Histone deacetylase 3 (Homo sapiens (Human))	BDBM476602 (N'-butylcinnamohydrazide | US10870618, Compound 1i) Show SMILES CCCCNNC(=O)\C=C\c1ccccc1 Show InChI InChI=1S/C13H18N2O/c1-2-3-11-14-15-13(16)10-9-12-7-5-4-6-8-12/h4-10,14H,2-3,11H2,1H3,(H,15,16)/b10-9+	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	PubMed	n/a	n/a	295	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Allosteric inhibition of C-terminal His-tagged recombinant human HDAC3 expressed in Sf9 cells pre-incubated for 2 hrs before acetylated lysine-aminom...				Citation and Details BindingDB Entry DOI: 10.7270/Q2H70KFJ
					More data for this Ligand-Target Pair
Histone deacetylase 3 (Homo sapiens (Human))	BDBM476565 (N'-butyl-4- phenoxybenzohydrazide | US10870618, Co...) Show SMILES CCCCNNC(=O)c1ccc(Oc2ccccc2)cc1 Show InChI InChI=1S/C17H20N2O2/c1-2-3-13-18-19-17(20)14-9-11-16(12-10-14)21-15-7-5-4-6-8-15/h4-12,18H,2-3,13H2,1H3,(H,19,20)	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	PubMed	n/a	n/a	312	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Allosteric inhibition of C-terminal His-tagged recombinant human HDAC3 expressed in Sf9 cells pre-incubated for 2 hrs before acetylated lysine-aminom...				Citation and Details BindingDB Entry DOI: 10.7270/Q2H70KFJ
					More data for this Ligand-Target Pair
Histone deacetylase 3 (Homo sapiens (Human))	BDBM476622 (N-(4-(2-ethylhydrazine-1- carbonyl)benzyl)benzamid...) Show SMILES CCNNC(=O)c1ccc(CNC(=O)c2ccccc2)cc1 Show InChI InChI=1S/C17H19N3O2/c1-2-19-20-17(22)15-10-8-13(9-11-15)12-18-16(21)14-6-4-3-5-7-14/h3-11,19H,2,12H2,1H3,(H,18,21)(H,20,22)	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	PubMed	n/a	n/a	427	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Allosteric inhibition of HDAC3 in HEK293 cell lysates pre-incubated for 2 hrs before acetylated lysine-aminomethyl coumarin-BOC addition and measured...				Citation and Details BindingDB Entry DOI: 10.7270/Q2H70KFJ
					More data for this Ligand-Target Pair
Histone deacetylase 3 (Homo sapiens (Human))	BDBM476627 (N-(4-(2-butylhydrazine-1- carbonyl)benzyl)cinnamam...) Show SMILES CCCCNNC(=O)c1ccc(CNC(=O)\C=C\c2ccccc2)cc1 Show InChI InChI=1S/C21H25N3O2/c1-2-3-15-23-24-21(26)19-12-9-18(10-13-19)16-22-20(25)14-11-17-7-5-4-6-8-17/h4-14,23H,2-3,15-16H2,1H3,(H,22,25)(H,24,26)/b14-11+	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	PubMed	n/a	n/a	494	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Allosteric inhibition of HDAC3 in HEK293 cell lysates pre-incubated for 2 hrs before acetylated lysine-aminomethyl coumarin-BOC addition and measured...				Citation and Details BindingDB Entry DOI: 10.7270/Q2H70KFJ
					More data for this Ligand-Target Pair
Histone deacetylase 3 (Homo sapiens (Human))	BDBM476619 (N-(4-(2-hexylhydrazine-1- carbonyl)benzyl)benzamid...) Show SMILES CCCCCCNNC(=O)c1ccc(CNC(=O)c2ccccc2)cc1 Show InChI InChI=1S/C21H27N3O2/c1-2-3-4-8-15-23-24-21(26)19-13-11-17(12-14-19)16-22-20(25)18-9-6-5-7-10-18/h5-7,9-14,23H,2-4,8,15-16H2,1H3,(H,22,25)(H,24,26)	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	PubMed	n/a	n/a	550	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Allosteric inhibition of HDAC3 in HEK293 cell lysates pre-incubated for 2 hrs before acetylated lysine-aminomethyl coumarin-BOC addition and measured...				Citation and Details BindingDB Entry DOI: 10.7270/Q2H70KFJ
					More data for this Ligand-Target Pair
Histone deacetylase 3 (Homo sapiens (Human))	BDBM476617 (N-(4-(2-heptylhydrazine-1- carbonyl)benzyl)benzami...) Show SMILES CCCCCCCNNC(=O)c1ccc(CNC(=O)c2ccccc2)cc1 Show InChI InChI=1S/C22H29N3O2/c1-2-3-4-5-9-16-24-25-22(27)20-14-12-18(13-15-20)17-23-21(26)19-10-7-6-8-11-19/h6-8,10-15,24H,2-5,9,16-17H2,1H3,(H,23,26)(H,25,27)	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	PubMed	n/a	n/a	569	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Allosteric inhibition of C-terminal His-tagged recombinant human HDAC3 expressed in Sf9 cells pre-incubated for 2 hrs before acetylated lysine-aminom...				Citation and Details BindingDB Entry DOI: 10.7270/Q2H70KFJ
					More data for this Ligand-Target Pair
Histone deacetylase 3 (Homo sapiens (Human))	BDBM476629 (N-(4-(2-pentylhydrazine-1- carbonyl)benzyl)cinnama...) Show SMILES CCCCCNNC(=O)c1ccc(CNC(=O)\C=C\c2ccccc2)cc1 Show InChI InChI=1S/C22H27N3O2/c1-2-3-7-16-24-25-22(27)20-13-10-19(11-14-20)17-23-21(26)15-12-18-8-5-4-6-9-18/h4-6,8-15,24H,2-3,7,16-17H2,1H3,(H,23,26)(H,25,27)/b15-12+	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	PubMed	n/a	n/a	691	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Allosteric inhibition of HDAC3 in HEK293 cell lysates pre-incubated for 2 hrs before acetylated lysine-aminomethyl coumarin-BOC addition and measured...				Citation and Details BindingDB Entry DOI: 10.7270/Q2H70KFJ
					More data for this Ligand-Target Pair
Histone deacetylase 3 (Homo sapiens (Human))	BDBM163623 (SR-3206 | US10807944, Compound RLS2-126 | US108706...) Show SMILES CCCCNNC(=O)c1ccc(OC)cc1 Show InChI InChI=1S/C12H18N2O2/c1-3-4-9-13-14-12(15)10-5-7-11(16-2)8-6-10/h5-8,13H,3-4,9H2,1-2H3,(H,14,15)	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	PubMed	n/a	n/a	727	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Allosteric inhibition of HDAC3 in HEK293 cell lysates pre-incubated for 2 hrs before acetylated lysine-aminomethyl coumarin-BOC addition and measured...				Citation and Details BindingDB Entry DOI: 10.7270/Q2H70KFJ
					More data for this Ligand-Target Pair
Histone deacetylase 3 (Homo sapiens (Human))	BDBM468586 (US10807944, Compound RLS2-238 | US10870618, Compou...) Show SMILES CCCCNNC(=O)c1ccc2ccccc2c1 Show InChI InChI=1S/C15H18N2O/c1-2-3-10-16-17-15(18)14-9-8-12-6-4-5-7-13(12)11-14/h4-9,11,16H,2-3,10H2,1H3,(H,17,18)	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	PubMed	n/a	n/a	892	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Allosteric inhibition of C-terminal His-tagged recombinant human HDAC3 expressed in Sf9 cells pre-incubated for 2 hrs before acetylated lysine-aminom...				Citation and Details BindingDB Entry DOI: 10.7270/Q2H70KFJ
					More data for this Ligand-Target Pair
Histone deacetylase 3 (Homo sapiens (Human))	BDBM476598 (N'-butylthiophene-2- carbohydrazide | US10870618, ...) Show SMILES CCCCNNC(=O)c1cccs1 Show InChI InChI=1S/C9H14N2OS/c1-2-3-6-10-11-9(12)8-5-4-7-13-8/h4-5,7,10H,2-3,6H2,1H3,(H,11,12)	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	PubMed	n/a	n/a	904	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Allosteric inhibition of C-terminal His-tagged recombinant human HDAC3 expressed in Sf9 cells pre-incubated for 2 hrs before acetylated lysine-aminom...				Citation and Details BindingDB Entry DOI: 10.7270/Q2H70KFJ
					More data for this Ligand-Target Pair
Histone deacetylase 3 (Homo sapiens (Human))	BDBM476618 (N-(4-(2-octylhydrazine-1- carbonyl)benzyl)benzamid...) Show SMILES CCCCCCCCNNC(=O)c1ccc(CNC(=O)c2ccccc2)cc1 Show InChI InChI=1S/C23H31N3O2/c1-2-3-4-5-6-10-17-25-26-23(28)21-15-13-19(14-16-21)18-24-22(27)20-11-8-7-9-12-20/h7-9,11-16,25H,2-6,10,17-18H2,1H3,(H,24,27)(H,26,28)	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	PubMed	n/a	n/a	1.09E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Allosteric inhibition of C-terminal His-tagged recombinant human HDAC3 expressed in Sf9 cells pre-incubated for 2 hrs before acetylated lysine-aminom...				Citation and Details BindingDB Entry DOI: 10.7270/Q2H70KFJ
					More data for this Ligand-Target Pair
Histone deacetylase 3 (Homo sapiens (Human))	BDBM476614 (N-(4-(2-(3,3,3- trifluoropropyl)hydrazine-1- carbo...) Show SMILES FC(F)(F)CCNNC(=O)c1ccc(CNC(=O)c2ccccc2)cc1 Show InChI InChI=1S/C18H18F3N3O2/c19-18(20,21)10-11-23-24-17(26)15-8-6-13(7-9-15)12-22-16(25)14-4-2-1-3-5-14/h1-9,23H,10-12H2,(H,22,25)(H,24,26)	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	PubMed	n/a	n/a	1.23E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Allosteric inhibition of HDAC3 in HEK293 cell lysates pre-incubated for 2 hrs before acetylated lysine-aminomethyl coumarin-BOC addition and measured...				Citation and Details BindingDB Entry DOI: 10.7270/Q2H70KFJ
					More data for this Ligand-Target Pair
Histone deacetylase 3 (Homo sapiens (Human))	BDBM468609 (US10807944, Compound RLS3-43 | US10870618, Compoun...) Show SMILES CCCCNNC(=O)c1ccc(cc1)-c1ccccc1 Show InChI InChI=1S/C17H20N2O/c1-2-3-13-18-19-17(20)16-11-9-15(10-12-16)14-7-5-4-6-8-14/h4-12,18H,2-3,13H2,1H3,(H,19,20)	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	PubMed	n/a	n/a	1.31E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Allosteric inhibition of HDAC3 in HEK293 cell lysates pre-incubated for 2 hrs before acetylated lysine-aminomethyl coumarin-BOC addition and measured...				Citation and Details BindingDB Entry DOI: 10.7270/Q2H70KFJ
					More data for this Ligand-Target Pair
Histone deacetylase 3 (Homo sapiens (Human))	BDBM476564 (N'-butylbenzofuran-2- carbohydrazide | US10870618,...) Show SMILES CCCCNNC(=O)c1cc2ccccc2o1 Show InChI InChI=1S/C13H16N2O2/c1-2-3-8-14-15-13(16)12-9-10-6-4-5-7-11(10)17-12/h4-7,9,14H,2-3,8H2,1H3,(H,15,16)	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	PubMed	n/a	n/a	1.36E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Allosteric inhibition of C-terminal His-tagged recombinant human HDAC3 expressed in Sf9 cells pre-incubated for 2 hrs before acetylated lysine-aminom...				Citation and Details BindingDB Entry DOI: 10.7270/Q2H70KFJ
					More data for this Ligand-Target Pair
Histone deacetylase 3 (Homo sapiens (Human))	BDBM476602 (N'-butylcinnamohydrazide | US10870618, Compound 1i) Show SMILES CCCCNNC(=O)\C=C\c1ccccc1 Show InChI InChI=1S/C13H18N2O/c1-2-3-11-14-15-13(16)10-9-12-7-5-4-6-8-12/h4-10,14H,2-3,11H2,1H3,(H,15,16)/b10-9+	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	PubMed	n/a	n/a	1.44E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Allosteric inhibition of HDAC3 in HEK293 cell lysates pre-incubated for 2 hrs before acetylated lysine-aminomethyl coumarin-BOC addition and measured...				Citation and Details BindingDB Entry DOI: 10.7270/Q2H70KFJ
					More data for this Ligand-Target Pair
Histone deacetylase 3 (Homo sapiens (Human))	BDBM468597 (US10807944, Compound RLS2-289 | US10870618, Compou...) Show SMILES CCCCNNC(=O)c1cccnc1 Show InChI InChI=1S/C10H15N3O/c1-2-3-7-12-13-10(14)9-5-4-6-11-8-9/h4-6,8,12H,2-3,7H2,1H3,(H,13,14)	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	PubMed	n/a	n/a	1.55E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Allosteric inhibition of C-terminal His-tagged recombinant human HDAC3 expressed in Sf9 cells pre-incubated for 2 hrs before acetylated lysine-aminom...				Citation and Details BindingDB Entry DOI: 10.7270/Q2H70KFJ
					More data for this Ligand-Target Pair
Histone deacetylase 3 (Homo sapiens (Human))	BDBM476607 ((E)-N-(4-(2-(but-2-en-1- yl)hydrazine-1- carbonyl)...) Show SMILES C\C=C\CNNC(=O)c1ccc(CNC(=O)c2ccccc2)cc1 Show InChI InChI=1S/C19H21N3O2/c1-2-3-13-21-22-19(24)17-11-9-15(10-12-17)14-20-18(23)16-7-5-4-6-8-16/h2-12,21H,13-14H2,1H3,(H,20,23)(H,22,24)/b3-2+	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	PubMed	n/a	n/a	1.55E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Allosteric inhibition of C-terminal His-tagged recombinant human HDAC3 expressed in Sf9 cells pre-incubated for 2 hrs before acetylated lysine-aminom...				Citation and Details BindingDB Entry DOI: 10.7270/Q2H70KFJ
					More data for this Ligand-Target Pair
Histone deacetylase 3 (Homo sapiens (Human))	BDBM476615 (N-(4-(2- (cyclopropylmethyl)hydrazine- 1-carbonyl)...) Show SMILES O=C(NCc1ccc(cc1)C(=O)NNCC1CC1)c1ccccc1 Show InChI InChI=1S/C19H21N3O2/c23-18(16-4-2-1-3-5-16)20-12-14-8-10-17(11-9-14)19(24)22-21-13-15-6-7-15/h1-5,8-11,15,21H,6-7,12-13H2,(H,20,23)(H,22,24)	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	PubMed	n/a	n/a	1.62E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Allosteric inhibition of HDAC3 in HEK293 cell lysates pre-incubated for 2 hrs before acetylated lysine-aminomethyl coumarin-BOC addition and measured...				Citation and Details BindingDB Entry DOI: 10.7270/Q2H70KFJ
					More data for this Ligand-Target Pair
Histone deacetylase 3 (Homo sapiens (Human))	BDBM476564 (N'-butylbenzofuran-2- carbohydrazide | US10870618,...) Show SMILES CCCCNNC(=O)c1cc2ccccc2o1 Show InChI InChI=1S/C13H16N2O2/c1-2-3-8-14-15-13(16)12-9-10-6-4-5-7-11(10)17-12/h4-7,9,14H,2-3,8H2,1H3,(H,15,16)	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	PubMed	n/a	n/a	1.69E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Allosteric inhibition of HDAC3 in HEK293 cell lysates pre-incubated for 2 hrs before acetylated lysine-aminomethyl coumarin-BOC addition and measured...				Citation and Details BindingDB Entry DOI: 10.7270/Q2H70KFJ
					More data for this Ligand-Target Pair
Histone deacetylase 3 (Homo sapiens (Human))	BDBM476565 (N'-butyl-4- phenoxybenzohydrazide | US10870618, Co...) Show SMILES CCCCNNC(=O)c1ccc(Oc2ccccc2)cc1 Show InChI InChI=1S/C17H20N2O2/c1-2-3-13-18-19-17(20)14-9-11-16(12-10-14)21-15-7-5-4-6-8-15/h4-12,18H,2-3,13H2,1H3,(H,19,20)	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	PubMed	n/a	n/a	1.69E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Allosteric inhibition of HDAC3 in HEK293 cell lysates pre-incubated for 2 hrs before acetylated lysine-aminomethyl coumarin-BOC addition and measured...				Citation and Details BindingDB Entry DOI: 10.7270/Q2H70KFJ
					More data for this Ligand-Target Pair

Displayed 1 to 50 (of 70 total )  |  Next  |  Last  >>

Jump to: