Marvin 2D Structure

The following exact ligands are found in BindingDB

Wt: 376.4 BDBM153522

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

Found 1 hit 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
Dipeptidyl peptidase 1 (Homo sapiens (Human))	BDBM153522 (US8999975, 39) Show SMILES O=C(N[C@@H](Cc1ccc(cc1)-n1cc(nn1)C1CC1)C#N)[C@H]1N[C@@H]2CC[C@H]1C2 |r| Show InChI InChI=1S/C21H24N6O/c22-11-17(24-21(28)20-15-5-6-16(10-15)23-20)9-13-1-7-18(8-2-13)27-12-19(25-26-27)14-3-4-14/h1-2,7-8,12,14-17,20,23H,3-6,9-10H2,(H,24,28)/t15-,16+,17-,20-/m0/s1	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	37	n/a	n/a	n/a	n/a	6.0	25
Boehringer Ingelheim International GmbH US Patent					Assay Description The following buffers were used: MES buffer: 25 mM MES, 50 mM NaCl, 5 mM DTT, adjusted to pH 6.0, containing 0.1% BSA; TAGZyme Buffer: 20 mM NaH2PO4,...				US Patent US8999975 (2015) BindingDB Entry DOI: 10.7270/Q22806BZ
					More data for this Ligand-Target Pair