BDBM50177986 (S)-sirtinol::CHEMBL197282

SMILES: C[C@H](NC(=O)c1ccccc1\N=C\c1c(O)ccc2ccccc12)c1ccccc1

InChI Key: InChIKey=UXJFDYIHRJGPFS-CICSQNLLSA-N

Data: 3 IC50

Find this compound or compounds like it in BindingDB or PDB:

Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 50177986   

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
NAD-Dependent Deacetylase Sirtuin-1 (Homo sapiens (Human))	BDBM50177986 ((S)-sirtinol | CHEMBL197282) Show SMILES C[C@H](NC(=O)c1ccccc1\N=C\c1c(O)ccc2ccccc12)c1ccccc1 Show InChI InChI=1S/C26H22N2O2/c1-18(19-9-3-2-4-10-19)28-26(30)22-13-7-8-14-24(22)27-17-23-21-12-6-5-11-20(21)15-16-25(23)29/h2-18,29H,1H3,(H,28,30)/b27-17+/t18-/m0/s1	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	6.70E+4	n/a	n/a	n/a	n/a	n/a	n/a
Università degli Studi di Roma "La Sapienza" Curated by ChEMBL					Assay Description Inhibitory activity against human SIRT1				J Med Chem 48: 7789-95 (2005) Article DOI: 10.1021/jm050100l BindingDB Entry DOI: 10.7270/Q26M36DP
					More data for this Ligand-Target Pair
NAD-dependent deacetylase sirtuin 2 (Homo sapiens (Human))	BDBM50177986 ((S)-sirtinol | CHEMBL197282) Show SMILES C[C@H](NC(=O)c1ccccc1\N=C\c1c(O)ccc2ccccc12)c1ccccc1 Show InChI InChI=1S/C26H22N2O2/c1-18(19-9-3-2-4-10-19)28-26(30)22-13-7-8-14-24(22)27-17-23-21-12-6-5-11-20(21)15-16-25(23)29/h2-18,29H,1H3,(H,28,30)/b27-17+/t18-/m0/s1	PDB MMDB NCI pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	3.94E+4	n/a	n/a	n/a	n/a	n/a	n/a
Università degli Studi di Roma "La Sapienza" Curated by ChEMBL					Assay Description Inhibitory activity against human SIRT2				J Med Chem 48: 7789-95 (2005) Article DOI: 10.1021/jm050100l BindingDB Entry DOI: 10.7270/Q26M36DP
					More data for this Ligand-Target Pair
NAD-dependent histone deacetylase SIR2 (Saccharomyces cerevisiae)	BDBM50177986 ((S)-sirtinol | CHEMBL197282) Show SMILES C[C@H](NC(=O)c1ccccc1\N=C\c1c(O)ccc2ccccc12)c1ccccc1 Show InChI InChI=1S/C26H22N2O2/c1-18(19-9-3-2-4-10-19)28-26(30)22-13-7-8-14-24(22)27-17-23-21-12-6-5-11-20(21)15-16-25(23)29/h2-18,29H,1H3,(H,28,30)/b27-17+/t18-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	6.60E+4	n/a	n/a	n/a	n/a	n/a	n/a
Università degli Studi di Roma "La Sapienza" Curated by ChEMBL					Assay Description Inhibitory activity against recombinant yeast Sir2				J Med Chem 48: 7789-95 (2005) Article DOI: 10.1021/jm050100l BindingDB Entry DOI: 10.7270/Q26M36DP
					More data for this Ligand-Target Pair