Compile Data Set for Download or QSAR

Found 130 hits with Last Name = 'fan' and Initial = 'yc'   

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
G-protein coupled receptor 84 (Homo sapiens (Human))	BDBM50603899 (CHEMBL5205352) Show SMILES [Na;v0+].[#6]-[#8]-c1cccc-2c1-[#16]-c1cccc(F)c1-[#6]=[#6]-2-[#8]P([#8-])(=O)[#8]-[#6]-1=[#6]-c2c(F)cccc2-[#16]-c2c(-[#8]-[#6])cccc-12 |c:18,t:26| Show InChI	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	4.60	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details Article DOI: 10.1021/acs.jmedchem.1c01813 BindingDB Entry DOI: 10.7270/Q24X5CVT
					More data for this Ligand-Target Pair
Histone deacetylase 6 (Homo sapiens (Human))	BDBM50005711 (CHEBI:46024 | GNF-Pf-1011 | TRICHOSTATIN | Trichos...) Show SMILES C[C@H](\C=C(/C)\C=C\C(=O)NO)C(=O)c1ccc(cc1)N(C)C |r| Show InChI InChI=1S/C17H22N2O3/c1-12(5-10-16(20)18-22)11-13(2)17(21)14-6-8-15(9-7-14)19(3)4/h5-11,13,22H,1-4H3,(H,18,20)/b10-5+,12-11+/t13-/m1/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase DrugBank MCE PC cid PC sid PDB UniChem	PDB Article PubMed	n/a	n/a	6.10	n/a	n/a	n/a	n/a	n/a	n/a
Taipei Medical University Curated by ChEMBL					Assay Description Inhibition of recombinant human N-terminal GST-tagged HDAC6 (1 to 1215 residues) expressed in baculovirus infected insect cells using RHK-K(Ac)-AMC a...				Eur J Med Chem 187: (2020) Article DOI: 10.1016/j.ejmech.2019.111915 BindingDB Entry DOI: 10.7270/Q2862KZH
					More data for this Ligand-Target Pair				3D Structure (crystal)
G-protein coupled receptor 84 (Homo sapiens (Human))	BDBM50603880 (CHEMBL5191944) Show SMILES [Na;v0+].[#6]-[#8]-c1cccc-2c1-[#16]-c1ccccc1-[#6]=[#6]-2-[#8]P([#8-])(=O)[#8]-[#6]-1=[#6]-c2ccccc2-[#16]-c2c(-[#8]-[#6])cccc-12 |c:17,t:25| Show InChI	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	6.70	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details Article DOI: 10.1021/acs.jmedchem.1c01813 BindingDB Entry DOI: 10.7270/Q24X5CVT
					More data for this Ligand-Target Pair
G-protein coupled receptor 84 (Homo sapiens (Human))	BDBM50603895 (CHEMBL5179395) Show SMILES [Na;v0+].[#8-]P(=O)([#8]-[#6]-1=[#6]-c2c(Cl)cccc2-[#16]-c2ccccc-12)[#8]-[#6]-1=[#6]-c2c(Cl)cccc2-[#16]-c2ccccc-12 |t:4,24| Show InChI	PDB UniProtKB/SwissProt 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
TBA									Citation and Details Article DOI: 10.1021/acs.jmedchem.1c01813 BindingDB Entry DOI: 10.7270/Q24X5CVT
					More data for this Ligand-Target Pair
G-protein coupled receptor 84 (Homo sapiens (Human))	BDBM50603901 (CHEMBL5176994) Show SMILES [Na;v0+].[#6]-[#8]-c1cccc-2c1-[#16]-c1cc(F)ccc1-[#6]=[#6]-2-[#8]P([#8-])(=O)[#8]-[#6]-1=[#6]-c2ccc(F)cc2-[#16]-c2c(-[#8]-[#6])cccc-12 |c:18,t:26| Show InChI	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	9.40	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details Article DOI: 10.1021/acs.jmedchem.1c01813 BindingDB Entry DOI: 10.7270/Q24X5CVT
					More data for this Ligand-Target Pair
G-protein coupled receptor 84 (Homo sapiens (Human))	BDBM50603875 (CHEMBL5206571) Show SMILES [Na;v0+].[#8-]P(=O)([#8]-[#6]-1=[#6]-c2ccccc2-[#6]-c2ccccc-12)[#8]-[#6]-1=[#6]-c2ccccc2-[#6]-c2ccccc-12 |t:4,23| Show InChI	PDB UniProtKB/SwissProt 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
TBA									Citation and Details Article DOI: 10.1021/acs.jmedchem.1c01813 BindingDB Entry DOI: 10.7270/Q24X5CVT
					More data for this Ligand-Target Pair
Histone deacetylase 1 (Homo sapiens (Human))	BDBM50005711 (CHEBI:46024 | GNF-Pf-1011 | TRICHOSTATIN | Trichos...) Show SMILES C[C@H](\C=C(/C)\C=C\C(=O)NO)C(=O)c1ccc(cc1)N(C)C |r| Show InChI InChI=1S/C17H22N2O3/c1-12(5-10-16(20)18-22)11-13(2)17(21)14-6-8-15(9-7-14)19(3)4/h5-11,13,22H,1-4H3,(H,18,20)/b10-5+,12-11+/t13-/m1/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase DrugBank MCE PC cid PC sid PDB UniChem	Article PubMed	n/a	n/a	15.8	n/a	n/a	n/a	n/a	n/a	n/a
Taipei Medical University Curated by ChEMBL					Assay Description Inhibition of recombinant full length human C-terminal FLAG/His-tagged HDAC1 (1 to 482 residues) expressed in baculovirus infected Sf21 cells using R...				Eur J Med Chem 187: (2020) Article DOI: 10.1016/j.ejmech.2019.111915 BindingDB Entry DOI: 10.7270/Q2862KZH
					More data for this Ligand-Target Pair
G-protein coupled receptor 84 (Homo sapiens (Human))	BDBM50603904 (CHEMBL5197375) Show SMILES [Na;v0+].[#6]-[#8]-c1ccc2-[#6]=[#6](-[#8]P([#8-])(=O)[#8]-[#6]-3=[#6]-c4ccc(-[#8]-[#6])cc4-[#16]-c4c(-[#8]-[#6])cccc-34)-c3cccc(-[#8]-[#6])c3-[#16]-c2c1 |t:6,13| Show InChI	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	18	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details Article DOI: 10.1021/acs.jmedchem.1c01813 BindingDB Entry DOI: 10.7270/Q24X5CVT
					More data for this Ligand-Target Pair
G-protein coupled receptor 84 (Homo sapiens (Human))	BDBM50603900 (CHEMBL5190809) Show SMILES [Na;v0+].[#6]-[#8]-c1cccc-2c1-[#16]-c1ccc(F)cc1-[#6]=[#6]-2-[#8]P([#8-])(=O)[#8]-[#6]-1=[#6]-c2cc(F)ccc2-[#16]-c2c(-[#8]-[#6])cccc-12 |c:18,t:26| Show InChI	PDB UniProtKB/SwissProt 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
TBA									Citation and Details Article DOI: 10.1021/acs.jmedchem.1c01813 BindingDB Entry DOI: 10.7270/Q24X5CVT
					More data for this Ligand-Target Pair
G-protein coupled receptor 84 (Homo sapiens (Human))	BDBM50603881 (CHEMBL5202207) Show SMILES [Na;v0+].[#6]-[#8]-c1ccc-2c(-[#16]-c3ccccc3-[#6]=[#6]-2-[#8]P([#8-])(=O)[#8]-[#6]-2=[#6]-c3ccccc3-[#16]-c3cc(-[#8]-[#6])ccc-23)c1 |c:15,t:23| Show InChI	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	25	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details Article DOI: 10.1021/acs.jmedchem.1c01813 BindingDB Entry DOI: 10.7270/Q24X5CVT
					More data for this Ligand-Target Pair
Histone deacetylase 3/Nuclear receptor corepressor 2 (HDAC3/NCoR2) (Homo sapiens (Human))	BDBM50005711 (CHEBI:46024 | GNF-Pf-1011 | TRICHOSTATIN | Trichos...) Show SMILES C[C@H](\C=C(/C)\C=C\C(=O)NO)C(=O)c1ccc(cc1)N(C)C |r| Show InChI InChI=1S/C17H22N2O3/c1-12(5-10-16(20)18-22)11-13(2)17(21)14-6-8-15(9-7-14)19(3)4/h5-11,13,22H,1-4H3,(H,18,20)/b10-5+,12-11+/t13-/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia antibodypedia GoogleScholar AffyNet	Purchase DrugBank MCE PC cid PC sid PDB UniChem	Article PubMed	n/a	n/a	25.3	n/a	n/a	n/a	n/a	n/a	n/a
Taipei Medical University Curated by ChEMBL					Assay Description Inhibition of human recombinant full length C-terminal His-tagged HDAC3 (1 to 428 residues)/N-terminaL GST-tagged human recombinant NCOR2 (395 to 489...				Eur J Med Chem 187: (2020) Article DOI: 10.1016/j.ejmech.2019.111915 BindingDB Entry DOI: 10.7270/Q2862KZH
					More data for this Ligand-Target Pair
G-protein coupled receptor 84 (Homo sapiens (Human))	BDBM50603891 (CHEMBL5170437) Show SMILES [Na;v0+].[#8-]P(=O)([#8]-[#6]-1=[#6]-c2c(F)cccc2-[#16]-c2ccccc-12)[#8]-[#6]-1=[#6]-c2c(F)cccc2-[#16]-c2ccccc-12 |t:4,24| Show InChI	PDB UniProtKB/SwissProt 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
TBA									Citation and Details Article DOI: 10.1021/acs.jmedchem.1c01813 BindingDB Entry DOI: 10.7270/Q24X5CVT
					More data for this Ligand-Target Pair
G-protein coupled receptor 84 (Homo sapiens (Human))	BDBM50603902 (CHEMBL5201979) Show SMILES [Na;v0+].[#6]-[#8]-c1cccc-2c1-[#16]-c1c(F)cccc1-[#6]=[#6]-2-[#8]P([#8-])(=O)[#8]-[#6]-1=[#6]-c2cccc(F)c2-[#16]-c2c(-[#8]-[#6])cccc-12 |c:18,t:26| Show InChI	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	32	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details Article DOI: 10.1021/acs.jmedchem.1c01813 BindingDB Entry DOI: 10.7270/Q24X5CVT
					More data for this Ligand-Target Pair
G-protein coupled receptor 84 (Homo sapiens (Human))	BDBM50603868 (CHEMBL5201755) Show SMILES OP(=O)(OC1=Cc2ccccc2Sc2ccccc12)OC1=Cc2ccccc2Sc2ccccc12 |t:4,23| Show InChI	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	33	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details Article DOI: 10.1021/acs.jmedchem.1c01813 BindingDB Entry DOI: 10.7270/Q24X5CVT
					More data for this Ligand-Target Pair
G-protein coupled receptor 84 (Homo sapiens (Human))	BDBM50603882 (CHEMBL5171959) Show SMILES [Na;v0+].[#6]-[#8]-c1ccc2-[#16]-c3ccccc3-[#6]=[#6](-[#8]P([#8-])(=O)[#8]-[#6]-3=[#6]-c4ccccc4-[#16]-c4ccc(-[#8]-[#6])cc-34)-c2c1 |t:14,21| Show InChI	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	36	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details Article DOI: 10.1021/acs.jmedchem.1c01813 BindingDB Entry DOI: 10.7270/Q24X5CVT
					More data for this Ligand-Target Pair
G-protein coupled receptor 84 (Homo sapiens (Human))	BDBM50603886 (CHEMBL5192281) Show SMILES [Na;v0+].[#6]-c1ccc-2c(-[#16]-c3ccccc3-[#6]=[#6]-2-[#8]P([#8-])(=O)[#8]-[#6]-2=[#6]-c3ccccc3-[#16]-c3cc(-[#6])ccc-23)c1 |c:14,t:22| Show InChI	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	38	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details Article DOI: 10.1021/acs.jmedchem.1c01813 BindingDB Entry DOI: 10.7270/Q24X5CVT
					More data for this Ligand-Target Pair
Histone deacetylase 2 (Homo sapiens (Human))	BDBM50005711 (CHEBI:46024 | GNF-Pf-1011 | TRICHOSTATIN | Trichos...) Show SMILES C[C@H](\C=C(/C)\C=C\C(=O)NO)C(=O)c1ccc(cc1)N(C)C |r| Show InChI InChI=1S/C17H22N2O3/c1-12(5-10-16(20)18-22)11-13(2)17(21)14-6-8-15(9-7-14)19(3)4/h5-11,13,22H,1-4H3,(H,18,20)/b10-5+,12-11+/t13-/m1/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase DrugBank MCE PC cid PC sid PDB UniChem	Article PubMed	n/a	n/a	39.5	n/a	n/a	n/a	n/a	n/a	n/a
Taipei Medical University Curated by ChEMBL					Assay Description Inhibition of recombinant human C-terminal GST-tagged HDAC2 (1 to 488 residues) expressed in baculovirus infected sf21 cells using RHK-K(Ac)-AMC as s...				Eur J Med Chem 187: (2020) Article DOI: 10.1016/j.ejmech.2019.111915 BindingDB Entry DOI: 10.7270/Q2862KZH
					More data for this Ligand-Target Pair
G-protein coupled receptor 84 (Homo sapiens (Human))	BDBM50603892 (CHEMBL5195150) Show SMILES [Na;v0+].[#8-]P(=O)([#8]-[#6]-1=[#6]-c2cc(F)ccc2-[#16]-c2ccccc-12)[#8]-[#6]-1=[#6]-c2cc(F)ccc2-[#16]-c2ccccc-12 |t:4,24| Show InChI	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	41	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details Article DOI: 10.1021/acs.jmedchem.1c01813 BindingDB Entry DOI: 10.7270/Q24X5CVT
					More data for this Ligand-Target Pair
G-protein coupled receptor 84 (Homo sapiens (Human))	BDBM50603877 (CHEMBL5183789) Show SMILES [Na;v0+].[#8-]P(=O)([#8]-[#6]-1=[#6]-c2ccccc2C2([#6]-[#6]2)c2ccccc-12)[#8]-[#6]-1=[#6]-c2ccccc2C2([#6]-[#6]2)c2ccccc-12 |t:4,26| Show InChI	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	45	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details Article DOI: 10.1021/acs.jmedchem.1c01813 BindingDB Entry DOI: 10.7270/Q24X5CVT
					More data for this Ligand-Target Pair
G-protein coupled receptor 84 (Homo sapiens (Human))	BDBM50603883 (CHEMBL5198754) Show SMILES [Na;v0+].[#6]-[#6]-[#8]-c1cccc-2c1-[#16]-c1ccccc1-[#6]=[#6]-2-[#8]P([#8-])(=O)[#8]-[#6]-1=[#6]-c2ccccc2-[#16]-c2c(-[#8]-[#6]-[#6])cccc-12 |c:18,t:26| Show InChI	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	46	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details Article DOI: 10.1021/acs.jmedchem.1c01813 BindingDB Entry DOI: 10.7270/Q24X5CVT
					More data for this Ligand-Target Pair
G-protein coupled receptor 84 (Homo sapiens (Human))	BDBM50603903 (CHEMBL5175363) Show SMILES [Na;v0+].[#6]-[#8]-c1ccc2-[#16]-c3c(-[#8]-[#6])cccc3-[#6](-[#8]P([#8-])(=O)[#8]-[#6]-3=[#6]-c4cc(-[#8]-[#6])ccc4-[#16]-c4c(-[#8]-[#6])cccc-34)=[#6]-c2c1 |c:43,t:22| Show InChI	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	56	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details Article DOI: 10.1021/acs.jmedchem.1c01813 BindingDB Entry DOI: 10.7270/Q24X5CVT
					More data for this Ligand-Target Pair
G-protein coupled receptor 84 (Homo sapiens (Human))	BDBM50548385 (Glpg-1205 | Glpg1205) Show SMILES O=c1nc(OC[C@@H]2COCCO2)cc2-c3ccc(cc3CCn12)C#CC1CC1 |r| Show InChI	PDB UniProtKB/SwissProt GoogleScholar AffyNet	Purchase MCE PC cid PC sid UniChem	Article PubMed	n/a	n/a	58	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details Article DOI: 10.1021/acs.jmedchem.1c01813 BindingDB Entry DOI: 10.7270/Q24X5CVT
					More data for this Ligand-Target Pair
Histone deacetylase 6 (Homo sapiens (Human))	BDBM50537748 (CHEMBL4636051) Show SMILES ONC(=O)CCCCCC(=O)NCCCN1c2ccccc2CCc2ccc(Cl)cc12 Show InChI InChI=1S/C24H30ClN3O3/c25-20-14-13-19-12-11-18-7-4-5-8-21(18)28(22(19)17-20)16-6-15-26-23(29)9-2-1-3-10-24(30)27-31/h4-5,7-8,13-14,17,31H,1-3,6,9-12,15-16H2,(H,26,29)(H,27,30)	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	61.6	n/a	n/a	n/a	n/a	n/a	n/a
Taipei Medical University Curated by ChEMBL					Assay Description Inhibition of recombinant human N-terminal GST-tagged HDAC6 (1 to 1215 residues) expressed in baculovirus infected insect cells using RHK-K(Ac)-AMC a...				Eur J Med Chem 187: (2020) Article DOI: 10.1016/j.ejmech.2019.111915 BindingDB Entry DOI: 10.7270/Q2862KZH
					More data for this Ligand-Target Pair
G-protein coupled receptor 84 (Homo sapiens (Human))	BDBM50603887 (CHEMBL5192624) Show SMILES [Na;v0+].[#6]-c1ccc2-[#16]-c3ccccc3-[#6]=[#6](-[#8]P([#8-])(=O)[#8]-[#6]-3=[#6]-c4ccccc4-[#16]-c4ccc(-[#6])cc-34)-c2c1 |t:13,20| Show InChI	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	65	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details Article DOI: 10.1021/acs.jmedchem.1c01813 BindingDB Entry DOI: 10.7270/Q24X5CVT
					More data for this Ligand-Target Pair
G-protein coupled receptor 84 (Homo sapiens (Human))	BDBM50603869 (CHEMBL5194984) Show SMILES [Na;v0+].[#8-]P(=O)([#8]-[#6]-1=[#6]-c2ccccc2-[#16]-c2ccccc-12)[#8]-[#6]-1=[#6]-c2ccccc2-[#16]-c2ccccc-12 |t:4,23| Show InChI	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	75	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details Article DOI: 10.1021/acs.jmedchem.1c01813 BindingDB Entry DOI: 10.7270/Q24X5CVT
					More data for this Ligand-Target Pair
G-protein coupled receptor 84 (Homo sapiens (Human))	BDBM50603896 (CHEMBL5187339) Show SMILES [Na;v0+].[#8-]P(=O)([#8]-[#6]-1=[#6]-c2cc(Cl)ccc2-[#16]-c2ccccc-12)[#8]-[#6]-1=[#6]-c2cc(Cl)ccc2-[#16]-c2ccccc-12 |t:4,24| Show InChI	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	89	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details Article DOI: 10.1021/acs.jmedchem.1c01813 BindingDB Entry DOI: 10.7270/Q24X5CVT
					More data for this Ligand-Target Pair
G-protein coupled receptor 84 (Homo sapiens (Human))	BDBM50603885 (CHEMBL5177531) Show SMILES [Na;v0+].[#6]-c1cccc-2c1-[#16]-c1ccccc1-[#6]=[#6]-2-[#8]P([#8-])(=O)[#8]-[#6]-1=[#6]-c2ccccc2-[#16]-c2c(-[#6])cccc-12 |c:16,t:24| Show InChI	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	89	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details Article DOI: 10.1021/acs.jmedchem.1c01813 BindingDB Entry DOI: 10.7270/Q24X5CVT
					More data for this Ligand-Target Pair
G-protein coupled receptor 84 (Homo sapiens (Human))	BDBM50603895 (CHEMBL5179395) Show SMILES [Na;v0+].[#8-]P(=O)([#8]-[#6]-1=[#6]-c2c(Cl)cccc2-[#16]-c2ccccc-12)[#8]-[#6]-1=[#6]-c2c(Cl)cccc2-[#16]-c2ccccc-12 |t:4,24| Show InChI	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	107	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details Article DOI: 10.1021/acs.jmedchem.1c01813 BindingDB Entry DOI: 10.7270/Q24X5CVT
					More data for this Ligand-Target Pair
G-protein coupled receptor 84 (Homo sapiens (Human))	BDBM50548385 (Glpg-1205 | Glpg1205) Show SMILES O=c1nc(OC[C@@H]2COCCO2)cc2-c3ccc(cc3CCn12)C#CC1CC1 |r| Show InChI	PDB UniProtKB/SwissProt GoogleScholar AffyNet	Purchase MCE PC cid PC sid UniChem	Article PubMed	n/a	n/a	112	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details Article DOI: 10.1021/acs.jmedchem.1c01813 BindingDB Entry DOI: 10.7270/Q24X5CVT
					More data for this Ligand-Target Pair
G-protein coupled receptor 84 (Homo sapiens (Human))	BDBM50603897 (CHEMBL5196560) Show SMILES [Na;v0+].[#8-]P(=O)([#8]-[#6]-1=[#6]-c2ccc(Cl)cc2-[#16]-c2ccccc-12)[#8]-[#6]-1=[#6]-c2ccc(Cl)cc2-[#16]-c2ccccc-12 |t:4,24| Show InChI	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	114	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details Article DOI: 10.1021/acs.jmedchem.1c01813 BindingDB Entry DOI: 10.7270/Q24X5CVT
					More data for this Ligand-Target Pair
G-protein coupled receptor 84 (Homo sapiens (Human))	BDBM50603869 (CHEMBL5194984) Show SMILES [Na;v0+].[#8-]P(=O)([#8]-[#6]-1=[#6]-c2ccccc2-[#16]-c2ccccc-12)[#8]-[#6]-1=[#6]-c2ccccc2-[#16]-c2ccccc-12 |t:4,23| Show InChI	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	118	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details Article DOI: 10.1021/acs.jmedchem.1c01813 BindingDB Entry DOI: 10.7270/Q24X5CVT
					More data for this Ligand-Target Pair
Histone deacetylase 6 (Homo sapiens (Human))	BDBM50537752 (CHEMBL4633944) Show SMILES ONC(=O)CCCCCCCCC(=O)NCCCN1c2ccccc2CCc2ccc(Cl)cc12 Show InChI InChI=1S/C27H36ClN3O3/c28-23-17-16-22-15-14-21-10-7-8-11-24(21)31(25(22)20-23)19-9-18-29-26(32)12-5-3-1-2-4-6-13-27(33)30-34/h7-8,10-11,16-17,20,34H,1-6,9,12-15,18-19H2,(H,29,32)(H,30,33)	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	142	n/a	n/a	n/a	n/a	n/a	n/a
Taipei Medical University Curated by ChEMBL					Assay Description Inhibition of recombinant human N-terminal GST-tagged HDAC6 (1 to 1215 residues) expressed in baculovirus infected insect cells using RHK-K(Ac)-AMC a...				Eur J Med Chem 187: (2020) Article DOI: 10.1016/j.ejmech.2019.111915 BindingDB Entry DOI: 10.7270/Q2862KZH
					More data for this Ligand-Target Pair
Histone deacetylase 6 (Homo sapiens (Human))	BDBM50537755 (CHEMBL4642616) Show SMILES ONC(=O)CCCCCCCC(=O)NCCCN1c2ccccc2CCc2ccc(Cl)cc12 Show InChI InChI=1S/C26H34ClN3O3/c27-22-16-15-21-14-13-20-9-6-7-10-23(20)30(24(21)19-22)18-8-17-28-25(31)11-4-2-1-3-5-12-26(32)29-33/h6-7,9-10,15-16,19,33H,1-5,8,11-14,17-18H2,(H,28,31)(H,29,32)	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	144	n/a	n/a	n/a	n/a	n/a	n/a
Taipei Medical University Curated by ChEMBL					Assay Description Inhibition of recombinant human N-terminal GST-tagged HDAC6 (1 to 1215 residues) expressed in baculovirus infected insect cells using RHK-K(Ac)-AMC a...				Eur J Med Chem 187: (2020) Article DOI: 10.1016/j.ejmech.2019.111915 BindingDB Entry DOI: 10.7270/Q2862KZH
					More data for this Ligand-Target Pair
G-protein coupled receptor 84 (Homo sapiens (Human))	BDBM50603873 (CHEMBL5189167) Show SMILES [Na;v0+].[#8-]P(=O)([#8]-[#6]-1=[#6]-c2ccccc2-[#8]-c2ccccc-12)[#8]-[#6]-1=[#6]-c2ccccc2-[#8]-c2ccccc-12 |t:4,23| Show InChI	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	146	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details Article DOI: 10.1021/acs.jmedchem.1c01813 BindingDB Entry DOI: 10.7270/Q24X5CVT
					More data for this Ligand-Target Pair
G-protein coupled receptor 84 (Homo sapiens (Human))	BDBM50603890 (CHEMBL5203023) Show SMILES [Na;v0+].[#8-]P(=O)([#8]-[#6]-1=[#6]-c2ccccc2-[#16]-c2ccc(F)cc-12)[#8]-[#6]-1=[#6]-c2ccccc2-[#16]-c2ccc(F)cc-12 |t:4,24| Show InChI	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	165	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details Article DOI: 10.1021/acs.jmedchem.1c01813 BindingDB Entry DOI: 10.7270/Q24X5CVT
					More data for this Ligand-Target Pair
G-protein coupled receptor 84 (Homo sapiens (Human))	BDBM50603878 (CHEMBL5179740) Show SMILES [Na;v0+].[#8-]P(=O)([#8]\[#6]-1=[#6]\c2ccccc2\[#6]=[#6]/c2ccccc12)[#8]\[#6]-1=[#6]\c2ccccc2\[#6]=[#6]/c2ccccc12 |c:13,33,t:4,24| Show InChI	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	220	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details Article DOI: 10.1021/acs.jmedchem.1c01813 BindingDB Entry DOI: 10.7270/Q24X5CVT
					More data for this Ligand-Target Pair
G-protein coupled receptor 84 (Homo sapiens (Human))	BDBM50603889 (CHEMBL5190004) Show SMILES [Na;v0+].[#8-]P(=O)([#8]-[#6]-1=[#6]-c2ccccc2-[#16]-c2cc(F)ccc-12)[#8]-[#6]-1=[#6]-c2ccccc2-[#16]-c2cc(F)ccc-12 |t:4,24| Show InChI	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	234	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details Article DOI: 10.1021/acs.jmedchem.1c01813 BindingDB Entry DOI: 10.7270/Q24X5CVT
					More data for this Ligand-Target Pair
G-protein coupled receptor 84 (Homo sapiens (Human))	BDBM50556781 (CHEMBL3719364) Show SMILES O=c1nc(OCC2COCCO2)cc2-c3ccc(OCc4ccccn4)cc3CCn12 Show InChI	PDB 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/acs.jmedchem.1c01813 BindingDB Entry DOI: 10.7270/Q24X5CVT
					More data for this Ligand-Target Pair
G-protein coupled receptor 84 (Homo sapiens (Human))	BDBM50603879 (CHEMBL5170786) Show SMILES [Na;v0+].[#8-]P(=O)([#8]\[#6]-1=[#6]\c2ccccc2-[#6]-[#6]-c2ccccc12)[#8]\[#6]-1=[#6]\c2ccccc2-[#6]-[#6]-c2ccccc12 |t:4,24| Show InChI	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	270	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details Article DOI: 10.1021/acs.jmedchem.1c01813 BindingDB Entry DOI: 10.7270/Q24X5CVT
					More data for this Ligand-Target Pair
G-protein coupled receptor 84 (Mus musculus)	BDBM50603895 (CHEMBL5179395) Show SMILES [Na;v0+].[#8-]P(=O)([#8]-[#6]-1=[#6]-c2c(Cl)cccc2-[#16]-c2ccccc-12)[#8]-[#6]-1=[#6]-c2c(Cl)cccc2-[#16]-c2ccccc-12 |t:4,24| Show InChI	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	273	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details Article DOI: 10.1021/acs.jmedchem.1c01813 BindingDB Entry DOI: 10.7270/Q24X5CVT
					More data for this Ligand-Target Pair
G-protein coupled receptor 84 (Homo sapiens (Human))	BDBM50603894 (CHEMBL5184044) Show SMILES [Na;v0+].[#8-]P(=O)([#8]-[#6]-1=[#6]-c2cccc(F)c2-[#16]-c2ccccc-12)[#8]-[#6]-1=[#6]-c2cccc(F)c2-[#16]-c2ccccc-12 |t:4,24| Show InChI	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	277	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details Article DOI: 10.1021/acs.jmedchem.1c01813 BindingDB Entry DOI: 10.7270/Q24X5CVT
					More data for this Ligand-Target Pair
G-protein coupled receptor 84 (Homo sapiens (Human))	BDBM50603893 (CHEMBL5198261) Show SMILES [Na;v0+].[#8-]P(=O)([#8]-[#6]-1=[#6]-c2ccc(F)cc2-[#16]-c2ccccc-12)[#8]-[#6]-1=[#6]-c2ccc(F)cc2-[#16]-c2ccccc-12 |t:4,24| Show InChI	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	305	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details Article DOI: 10.1021/acs.jmedchem.1c01813 BindingDB Entry DOI: 10.7270/Q24X5CVT
					More data for this Ligand-Target Pair
G-protein coupled receptor 84 (Homo sapiens (Human))	BDBM50603884 (CHEMBL5195223) Show SMILES [Na;v0+].[#6]-[#6](-[#6])-[#8]-c1cccc-2c1-[#16]-c1ccccc1-[#6]=[#6]-2-[#8]P([#8-])(=O)[#8]-[#6]-1=[#6]-c2ccccc2-[#16]-c2c(-[#8]-[#6](-[#6])-[#6])cccc-12 |c:19,t:27| Show InChI	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	321	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details Article DOI: 10.1021/acs.jmedchem.1c01813 BindingDB Entry DOI: 10.7270/Q24X5CVT
					More data for this Ligand-Target Pair
G-protein coupled receptor 84 (Homo sapiens (Human))	BDBM50603888 (CHEMBL5207051) Show SMILES [Na;v0+].[#8-]P(=O)([#8]-[#6]-1=[#6]-c2ccccc2-[#16]-c2c(F)cccc-12)[#8]-[#6]-1=[#6]-c2ccccc2-[#16]-c2c(F)cccc-12 |t:4,24| Show InChI	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	328	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details Article DOI: 10.1021/acs.jmedchem.1c01813 BindingDB Entry DOI: 10.7270/Q24X5CVT
					More data for this Ligand-Target Pair
Histone deacetylase 8 (Homo sapiens (Human))	BDBM50537748 (CHEMBL4636051) Show SMILES ONC(=O)CCCCCC(=O)NCCCN1c2ccccc2CCc2ccc(Cl)cc12 Show InChI InChI=1S/C24H30ClN3O3/c25-20-14-13-19-12-11-18-7-4-5-8-21(18)28(22(19)17-20)16-6-15-26-23(29)9-2-1-3-10-24(30)27-31/h4-5,7-8,13-14,17,31H,1-3,6,9-12,15-16H2,(H,26,29)(H,27,30)	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	345	n/a	n/a	n/a	n/a	n/a	n/a
Taipei Medical University Curated by ChEMBL					Assay Description Inhibition of recombinant C-terminal His-tagged and N-terminal Streptavidin2-tagged human HDAC8 (1 to 377 residues) expressed in baculovirus infected...				Eur J Med Chem 187: (2020) Article DOI: 10.1016/j.ejmech.2019.111915 BindingDB Entry DOI: 10.7270/Q2862KZH
					More data for this Ligand-Target Pair
G-protein coupled receptor 84 (Homo sapiens (Human))	BDBM50603906 (CHEMBL5170482) Show SMILES N#CC1=Cc2ccccc2Sc2ccccc12 |t:2| Show InChI	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	345	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details Article DOI: 10.1021/acs.jmedchem.1c01813 BindingDB Entry DOI: 10.7270/Q24X5CVT
					More data for this Ligand-Target Pair
G-protein coupled receptor 84 (Homo sapiens (Human))	BDBM50603905 (CHEMBL5188247) Show SMILES [Na;v0+].[#6]-[#8]-c1cccc2-[#6]=[#6](-[#8]P([#8-])(=O)[#8]-[#6]-3=[#6]-c4cccc(-[#8]-[#6])c4-[#16]-c4c(-[#8]-[#6])cccc-34)-c3cccc(-[#8]-[#6])c3-[#16]-c12 |t:7,14| Show InChI	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	369	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details Article DOI: 10.1021/acs.jmedchem.1c01813 BindingDB Entry DOI: 10.7270/Q24X5CVT
					More data for this Ligand-Target Pair
G-protein coupled receptor 84 (Homo sapiens (Human))	BDBM50603871 (CHEMBL5174911) Show SMILES [Na;v0+].[#8-]P(=O)([#8]-c1c2ccccc2cc2ccccc12)[#8]-c1c2ccccc2cc2ccccc12 Show InChI	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	380	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details Article DOI: 10.1021/acs.jmedchem.1c01813 BindingDB Entry DOI: 10.7270/Q24X5CVT
					More data for this Ligand-Target Pair
G-protein coupled receptor 84 (Homo sapiens (Human))	BDBM50603898 (CHEMBL5196283) Show SMILES [Na;v0+].[#8-]P(=O)([#8]-[#6]-1=[#6]-c2cccc(Cl)c2-[#16]-c2ccccc-12)[#8]-[#6]-1=[#6]-c2cccc(Cl)c2-[#16]-c2ccccc-12 |t:4,24| Show InChI	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	403	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details Article DOI: 10.1021/acs.jmedchem.1c01813 BindingDB Entry DOI: 10.7270/Q24X5CVT
					More data for this Ligand-Target Pair
G-protein coupled receptor 84 (Homo sapiens (Human))	BDBM50603869 (CHEMBL5194984) Show SMILES [Na;v0+].[#8-]P(=O)([#8]-[#6]-1=[#6]-c2ccccc2-[#16]-c2ccccc-12)[#8]-[#6]-1=[#6]-c2ccccc2-[#16]-c2ccccc-12 |t:4,23| Show InChI	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	413	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details Article DOI: 10.1021/acs.jmedchem.1c01813 BindingDB Entry DOI: 10.7270/Q24X5CVT
					More data for this Ligand-Target Pair

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