null

SMILES: [H][C@]12[C@@H](C)C3=NCCN1C(=O)O[C@]2(C)[C@@H](CC)OC(=O)[C@H](C)C(=O)[C@H](C)[C@@H](O[C@]1([H])O[C@H](C)C[C@@H]([C@H]1O)N(C)Cc1ccc(cc1)-c1cn(CCCC(=O)NO)nn1)[C@](C)(C[C@H]3C)OC

InChI Key: InChIKey=DMSLFIJGPOWLSK-XDVDDQMGSA-N

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 50499328   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kcal/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Histone deacetylase 1 (Homo sapiens (Human))	BDBM50499328 (CHEMBL3735456) Show SMILES [H][C@]12[C@@H](C)C3=NCCN1C(=O)O[C@]2(C)[C@@H](CC)OC(=O)[C@H](C)C(=O)[C@H](C)[C@@H](O[C@]1([H])O[C@H](C)C[C@@H]([C@H]1O)N(C)Cc1ccc(cc1)-c1cn(CCCC(=O)NO)nn1)[C@](C)(C[C@H]3C)OC |r,c:4| Show InChI InChI=1S/C45H67N7O11/c1-11-34-45(8)39-27(4)36(46-18-20-52(39)43(57)63-45)25(2)22-44(7,59-10)40(28(5)37(54)29(6)41(56)61-34)62-42-38(55)33(21-26(3)60-42)50(9)23-30-14-16-31(17-15-30)32-24-51(49-47-32)19-12-13-35(53)48-58/h14-17,24-29,33-34,38-40,42,55,58H,11-13,18-23H2,1-10H3,(H,48,53)/t25-,26-,27+,28+,29-,33+,34-,38-,39-,40-,42+,44+,45-/m1/s1	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+4	n/a	n/a	n/a	n/a	n/a	n/a
Georgia Institute of Technology Curated by ChEMBL					Assay Description Inhibition of recombinant HDAC1 (unknown origin) expressed in Escherichia coli BL21(DE3) after 60 mins using trichostatin A by label-free mass spectr...				Bioorg Med Chem 23: 7543-64 (2015) Article DOI: 10.1016/j.bmc.2015.10.045 BindingDB Entry DOI: 10.7270/Q2RX9G2V
					More data for this Ligand-Target Pair
Histone deacetylase 6 (Homo sapiens (Human))	BDBM50499328 (CHEMBL3735456) Show SMILES [H][C@]12[C@@H](C)C3=NCCN1C(=O)O[C@]2(C)[C@@H](CC)OC(=O)[C@H](C)C(=O)[C@H](C)[C@@H](O[C@]1([H])O[C@H](C)C[C@@H]([C@H]1O)N(C)Cc1ccc(cc1)-c1cn(CCCC(=O)NO)nn1)[C@](C)(C[C@H]3C)OC |r,c:4| Show InChI InChI=1S/C45H67N7O11/c1-11-34-45(8)39-27(4)36(46-18-20-52(39)43(57)63-45)25(2)22-44(7,59-10)40(28(5)37(54)29(6)41(56)61-34)62-42-38(55)33(21-26(3)60-42)50(9)23-30-14-16-31(17-15-30)32-24-51(49-47-32)19-12-13-35(53)48-58/h14-17,24-29,33-34,38-40,42,55,58H,11-13,18-23H2,1-10H3,(H,48,53)/t25-,26-,27+,28+,29-,33+,34-,38-,39-,40-,42+,44+,45-/m1/s1	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	194	n/a	n/a	n/a	n/a	n/a	n/a
Georgia Institute of Technology Curated by ChEMBL					Assay Description Inhibition of recombinant HDAC6 (unknown origin) expressed in Escherichia coli BL21(DE3) after 60 mins using trichostatin A by label-free mass spectr...				Bioorg Med Chem 23: 7543-64 (2015) Article DOI: 10.1016/j.bmc.2015.10.045 BindingDB Entry DOI: 10.7270/Q2RX9G2V
					More data for this Ligand-Target Pair
Histone deacetylase 8 (Homo sapiens (Human))	BDBM50499328 (CHEMBL3735456) Show SMILES [H][C@]12[C@@H](C)C3=NCCN1C(=O)O[C@]2(C)[C@@H](CC)OC(=O)[C@H](C)C(=O)[C@H](C)[C@@H](O[C@]1([H])O[C@H](C)C[C@@H]([C@H]1O)N(C)Cc1ccc(cc1)-c1cn(CCCC(=O)NO)nn1)[C@](C)(C[C@H]3C)OC |r,c:4| Show InChI InChI=1S/C45H67N7O11/c1-11-34-45(8)39-27(4)36(46-18-20-52(39)43(57)63-45)25(2)22-44(7,59-10)40(28(5)37(54)29(6)41(56)61-34)62-42-38(55)33(21-26(3)60-42)50(9)23-30-14-16-31(17-15-30)32-24-51(49-47-32)19-12-13-35(53)48-58/h14-17,24-29,33-34,38-40,42,55,58H,11-13,18-23H2,1-10H3,(H,48,53)/t25-,26-,27+,28+,29-,33+,34-,38-,39-,40-,42+,44+,45-/m1/s1	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	2.24E+3	n/a	n/a	n/a	n/a	n/a	n/a
Georgia Institute of Technology Curated by ChEMBL					Assay Description Inhibition of recombinant HDAC8 (unknown origin) expressed in Escherichia coli BL21(DE3) after 60 mins using trichostatin A by label-free mass spectr...				Bioorg Med Chem 23: 7543-64 (2015) Article DOI: 10.1016/j.bmc.2015.10.045 BindingDB Entry DOI: 10.7270/Q2RX9G2V
					More data for this Ligand-Target Pair