Marvin 2D Structure

The following exact ligands are found in BindingDB

Wt: 220.3 BDBM80495Purchase

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB (change energy unit to kcal/mol)

Found 2 hits in this display   

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
DNA dC->dU-editing enzyme APOBEC-3A (Homo sapiens (Human))	BDBM80495 (2,4,10b-trimethyl-2,3,5,6,7,8,9,10-octahydro-1H-py...) Show SMILES CC1CC2(C)C3=C(CCCC3)CC[N+]2(C)C1 |t:5| Show InChI InChI=1S/C15H26N/c1-12-10-15(2)14-7-5-4-6-13(14)8-9-16(15,3)11-12/h12H,4-11H2,1-3H3/q+1	PDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Similars	PCBioAssay	n/a	n/a	2.81E+3	n/a	n/a	n/a	n/a	n/a	25
Burnham Center for Chemical Genomics Curated by PubChem BioAssay					Assay Description Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...				PubChem Bioassay (2011) BindingDB Entry DOI: 10.7270/Q24F1P6P
					More data for this Ligand-Target Pair
DNA dC->dU-editing enzyme APOBEC-3G (Homo sapiens (Human))	BDBM80495 (2,4,10b-trimethyl-2,3,5,6,7,8,9,10-octahydro-1H-py...) Show SMILES CC1CC2(C)C3=C(CCCC3)CC[N+]2(C)C1 |t:5| Show InChI InChI=1S/C15H26N/c1-12-10-15(2)14-7-5-4-6-13(14)8-9-16(15,3)11-12/h12H,4-11H2,1-3H3/q+1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Similars	PCBioAssay	n/a	n/a	3.39E+3	n/a	n/a	n/a	n/a	n/a	25
Burnham Center for Chemical Genomics Curated by PubChem BioAssay					Assay Description Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...				PubChem Bioassay (2011) BindingDB Entry DOI: 10.7270/Q2862DX0
					More data for this Ligand-Target Pair