BDBM50463326 CHEMBL4242321

SMILES: [H][C@]12CC[C@](C)([C@H](C1)NCC(=O)N1CCC[C@H]1C#N)C2(C)C

InChI Key: InChIKey=MDIWPVUJDDNXFG-AYMQEEERSA-N

Data: 1 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 1 hit for monomerid = 50463326   

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
Dipeptidyl peptidase 4 (Homo sapiens (Human))	BDBM50463326 (CHEMBL4242321) Show SMILES [H][C@]12CC[C@](C)([C@H](C1)NCC(=O)N1CCC[C@H]1C#N)C2(C)C |r,THB:8:6:2.3:19| Show InChI InChI=1S/C17H27N3O/c1-16(2)12-6-7-17(16,3)14(9-12)19-11-15(21)20-8-4-5-13(20)10-18/h12-14,19H,4-9,11H2,1-3H3/t12-,13-,14-,17+/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.78E+3	n/a	n/a	n/a	n/a	n/a	n/a
Siberian Branch of the Russian Academy of Sciences Curated by ChEMBL					Assay Description Inhibition of recombinant human DPP4 using H-Gly-Pro-AMC as substrate measured after 10 mins				Bioorg Med Chem 26: 4402-4409 (2018) Article DOI: 10.1016/j.bmc.2018.07.018 BindingDB Entry DOI: 10.7270/Q2RV0RBN
					More data for this Ligand-Target Pair