BDBM323708 US10188756, Compound CN132

SMILES: ONC(=O)\C=C\c1ccc(CNCC23CC4CC(CC(C4)C2)C3)cc1

InChI Key: InChIKey=NGLDDIIVHRYURD-AATRIKPKSA-N

Data: 7 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 7 hits for monomerid = 323708   

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))	BDBM323708 (US10188756, Compound CN132) Show SMILES ONC(=O)\C=C\c1ccc(CNCC23CC4CC(CC(C4)C2)C3)cc1 |TLB:16:17:21:15.20.14,20:15:22:21.19.18,20:19:22:15.16.14,THB:16:15:21:22.17.18| Show InChI InChI=1S/C21H28N2O2/c24-20(23-25)6-5-15-1-3-16(4-2-15)13-22-14-21-10-17-7-18(11-21)9-19(8-17)12-21/h1-6,17-19,22,25H,7-14H2,(H,23,24)/b6-5+	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	0.950	n/a	n/a	n/a	n/a	n/a	n/a
The General Hospital Corporation US Patent					Assay Description All histone deacetylases were purchased from BPS Bioscience. The substrates, Broad Substrate A, and Broad Substrate B, were synthesized and are now a...				US Patent US10188756 (2019) BindingDB Entry DOI: 10.7270/Q20Z75CX
					More data for this Ligand-Target Pair
Histone deacetylase 2 (Homo sapiens (Human))	BDBM323708 (US10188756, Compound CN132) Show SMILES ONC(=O)\C=C\c1ccc(CNCC23CC4CC(CC(C4)C2)C3)cc1 |TLB:16:17:21:15.20.14,20:15:22:21.19.18,20:19:22:15.16.14,THB:16:15:21:22.17.18| Show InChI InChI=1S/C21H28N2O2/c24-20(23-25)6-5-15-1-3-16(4-2-15)13-22-14-21-10-17-7-18(11-21)9-19(8-17)12-21/h1-6,17-19,22,25H,7-14H2,(H,23,24)/b6-5+	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	7.80	n/a	n/a	n/a	n/a	n/a	n/a
The General Hospital Corporation US Patent					Assay Description All histone deacetylases were purchased from BPS Bioscience. The substrates, Broad Substrate A, and Broad Substrate B, were synthesized and are now a...				US Patent US10188756 (2019) BindingDB Entry DOI: 10.7270/Q20Z75CX
					More data for this Ligand-Target Pair
Histone deacetylase 3 (Homo sapiens (Human))	BDBM323708 (US10188756, Compound CN132) Show SMILES ONC(=O)\C=C\c1ccc(CNCC23CC4CC(CC(C4)C2)C3)cc1 |TLB:16:17:21:15.20.14,20:15:22:21.19.18,20:19:22:15.16.14,THB:16:15:21:22.17.18| Show InChI InChI=1S/C21H28N2O2/c24-20(23-25)6-5-15-1-3-16(4-2-15)13-22-14-21-10-17-7-18(11-21)9-19(8-17)12-21/h1-6,17-19,22,25H,7-14H2,(H,23,24)/b6-5+	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	1.20	n/a	n/a	n/a	n/a	n/a	n/a
The General Hospital Corporation US Patent					Assay Description All histone deacetylases were purchased from BPS Bioscience. The substrates, Broad Substrate A, and Broad Substrate B, were synthesized and are now a...				US Patent US10188756 (2019) BindingDB Entry DOI: 10.7270/Q20Z75CX
					More data for this Ligand-Target Pair
Histone deacetylase 9 (Homo sapiens (Human))	BDBM323708 (US10188756, Compound CN132) Show SMILES ONC(=O)\C=C\c1ccc(CNCC23CC4CC(CC(C4)C2)C3)cc1 |TLB:16:17:21:15.20.14,20:15:22:21.19.18,20:19:22:15.16.14,THB:16:15:21:22.17.18| Show InChI InChI=1S/C21H28N2O2/c24-20(23-25)6-5-15-1-3-16(4-2-15)13-22-14-21-10-17-7-18(11-21)9-19(8-17)12-21/h1-6,17-19,22,25H,7-14H2,(H,23,24)/b6-5+	Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
The General Hospital Corporation US Patent					Assay Description All histone deacetylases were purchased from BPS Bioscience. The substrates, Broad Substrate A, and Broad Substrate B, were synthesized and are now a...				US Patent US10188756 (2019) BindingDB Entry DOI: 10.7270/Q20Z75CX
					More data for this Ligand-Target Pair
Histone deacetylase 7 (Homo sapiens (Human))	BDBM323708 (US10188756, Compound CN132) Show SMILES ONC(=O)\C=C\c1ccc(CNCC23CC4CC(CC(C4)C2)C3)cc1 |TLB:16:17:21:15.20.14,20:15:22:21.19.18,20:19:22:15.16.14,THB:16:15:21:22.17.18| Show InChI InChI=1S/C21H28N2O2/c24-20(23-25)6-5-15-1-3-16(4-2-15)13-22-14-21-10-17-7-18(11-21)9-19(8-17)12-21/h1-6,17-19,22,25H,7-14H2,(H,23,24)/b6-5+	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	>2.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
The General Hospital Corporation US Patent					Assay Description All histone deacetylases were purchased from BPS Bioscience. The substrates, Broad Substrate A, and Broad Substrate B, were synthesized and are now a...				US Patent US10188756 (2019) BindingDB Entry DOI: 10.7270/Q20Z75CX
					More data for this Ligand-Target Pair
Histone deacetylase 8 (Homo sapiens (Human))	BDBM323708 (US10188756, Compound CN132) Show SMILES ONC(=O)\C=C\c1ccc(CNCC23CC4CC(CC(C4)C2)C3)cc1 |TLB:16:17:21:15.20.14,20:15:22:21.19.18,20:19:22:15.16.14,THB:16:15:21:22.17.18| Show InChI InChI=1S/C21H28N2O2/c24-20(23-25)6-5-15-1-3-16(4-2-15)13-22-14-21-10-17-7-18(11-21)9-19(8-17)12-21/h1-6,17-19,22,25H,7-14H2,(H,23,24)/b6-5+	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
The General Hospital Corporation US Patent					Assay Description All histone deacetylases were purchased from BPS Bioscience. The substrates, Broad Substrate A, and Broad Substrate B, were synthesized and are now a...				US Patent US10188756 (2019) BindingDB Entry DOI: 10.7270/Q20Z75CX
					More data for this Ligand-Target Pair
Cereblon/Histone deacetylase 6 (Homo sapiens (Human))	BDBM323708 (US10188756, Compound CN132) Show SMILES ONC(=O)\C=C\c1ccc(CNCC23CC4CC(CC(C4)C2)C3)cc1 |TLB:16:17:21:15.20.14,20:15:22:21.19.18,20:19:22:15.16.14,THB:16:15:21:22.17.18| Show InChI InChI=1S/C21H28N2O2/c24-20(23-25)6-5-15-1-3-16(4-2-15)13-22-14-21-10-17-7-18(11-21)9-19(8-17)12-21/h1-6,17-19,22,25H,7-14H2,(H,23,24)/b6-5+	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	1.70	n/a	n/a	n/a	n/a	n/a	n/a
The General Hospital Corporation US Patent					Assay Description All histone deacetylases were purchased from BPS Bioscience. The substrates, Broad Substrate A, and Broad Substrate B, were synthesized and are now a...				US Patent US10188756 (2019) BindingDB Entry DOI: 10.7270/Q20Z75CX
					More data for this Ligand-Target Pair