BDBM385059 (2S)-N- [(1S)-1-Cyano-2-{4-[2-oxo-3-(propan-2-yl)-2,3-dihydro-1,3-benzoxazol-5- yl]phenyl}ethyl]-1,4-oxazepane-2-carboxamide::US10287258, Example 19::US10669245, Example 19

SMILES: CC(C)n1c2cc(ccc2oc1=O)-c1ccc(C[C@H](NC(=O)[C@@H]2CNCCCO2)C#N)cc1

InChI Key: InChIKey=WOBKXJRTDASPHQ-REWPJTCUSA-N

Data: 2 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 = 385059   

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 I (Homo sapiens (Human))	BDBM385059 ((2S)-N- [(1S)-1-Cyano-2-{4-[2-oxo-3-(propan-2-yl)-...) Show SMILES CC(C)n1c2cc(ccc2oc1=O)-c1ccc(C[C@H](NC(=O)[C@@H]2CNCCCO2)C#N)cc1 Show InChI InChI=1S/C25H28N4O4/c1-16(2)29-21-13-19(8-9-22(21)33-25(29)31)18-6-4-17(5-7-18)12-20(14-26)28-24(30)23-15-27-10-3-11-32-23/h4-9,13,16,20,23,27H,3,10-12,15H2,1-2H3,(H,28,30)/t20-,23-/m0/s1	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	14.5	n/a	n/a	n/a	n/a	n/a	n/a
Novartis					Assay Description The activity of DPP1 was determined by measuring the enzymatic release of aminomethyl coumarin (AMC) from the peptide substrate (H-Gly-Arg-AMC), whic...				J Med Chem 51: 7049-52 (2008) BindingDB Entry DOI: 10.7270/Q2RJ4MTP
					More data for this Ligand-Target Pair
Dipeptidyl peptidase I (Homo sapiens (Human))	BDBM385059 ((2S)-N- [(1S)-1-Cyano-2-{4-[2-oxo-3-(propan-2-yl)-...) Show SMILES CC(C)n1c2cc(ccc2oc1=O)-c1ccc(C[C@H](NC(=O)[C@@H]2CNCCCO2)C#N)cc1 Show InChI InChI=1S/C25H28N4O4/c1-16(2)29-21-13-19(8-9-22(21)33-25(29)31)18-6-4-17(5-7-18)12-20(14-26)28-24(30)23-15-27-10-3-11-32-23/h4-9,13,16,20,23,27H,3,10-12,15H2,1-2H3,(H,28,30)/t20-,23-/m0/s1	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	14.5	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Dipeptidyl peptidase I (Homo sapiens (Human))	BDBM385059 ((2S)-N- [(1S)-1-Cyano-2-{4-[2-oxo-3-(propan-2-yl)-...) Show SMILES CC(C)n1c2cc(ccc2oc1=O)-c1ccc(C[C@H](NC(=O)[C@@H]2CNCCCO2)C#N)cc1 Show InChI InChI=1S/C25H28N4O4/c1-16(2)29-21-13-19(8-9-22(21)33-25(29)31)18-6-4-17(5-7-18)12-20(14-26)28-24(30)23-15-27-10-3-11-32-23/h4-9,13,16,20,23,27H,3,10-12,15H2,1-2H3,(H,28,30)/t20-,23-/m0/s1	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	14.5	n/a	n/a	n/a	n/a	n/a	n/a
ASTRAZENECA AB US Patent					Assay Description The activity of DPP1 was determined by measuring the enzymatic release of aminomethyl coumarin (AMC) from the peptide substrate (H-Gly-Arg-AMC), whic...				US Patent US10669245 (2020)
					More data for this Ligand-Target Pair