BDBM385057 (2S)-N-[(1S)-1-Cyano-2-{4-[3-(cyclopropylmethyl)-2-oxo-2,3-dihydro-1,3-benzoxazol- 5-yl]phenyl}ethyl]-1,4-oxazepane-2-carboxamide::US10287258, Example 17::US10669245, Example 17

SMILES: O=C(N[C@@H](Cc1ccc(cc1)-c1ccc2oc(=O)n(CC3CC3)c2c1)C#N)[C@@H]1CNCCCO1

InChI Key: InChIKey=WJXGZWWSCFPECN-URXFXBBRSA-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 = 385057   

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))	BDBM385057 ((2S)-N-[(1S)-1-Cyano-2-{4-[3-(cyclopropylmethyl)-2...) Show SMILES O=C(N[C@@H](Cc1ccc(cc1)-c1ccc2oc(=O)n(CC3CC3)c2c1)C#N)[C@@H]1CNCCCO1 Show InChI InChI=1S/C26H28N4O4/c27-14-21(29-25(31)24-15-28-10-1-11-33-24)12-17-4-6-19(7-5-17)20-8-9-23-22(13-20)30(26(32)34-23)16-18-2-3-18/h4-9,13,18,21,24,28H,1-3,10-12,15-16H2,(H,29,31)/t21-,24-/m0/s1	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	6.31	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))	BDBM385057 ((2S)-N-[(1S)-1-Cyano-2-{4-[3-(cyclopropylmethyl)-2...) Show SMILES O=C(N[C@@H](Cc1ccc(cc1)-c1ccc2oc(=O)n(CC3CC3)c2c1)C#N)[C@@H]1CNCCCO1 Show InChI InChI=1S/C26H28N4O4/c27-14-21(29-25(31)24-15-28-10-1-11-33-24)12-17-4-6-19(7-5-17)20-8-9-23-22(13-20)30(26(32)34-23)16-18-2-3-18/h4-9,13,18,21,24,28H,1-3,10-12,15-16H2,(H,29,31)/t21-,24-/m0/s1	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	6.31	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))	BDBM385057 ((2S)-N-[(1S)-1-Cyano-2-{4-[3-(cyclopropylmethyl)-2...) Show SMILES O=C(N[C@@H](Cc1ccc(cc1)-c1ccc2oc(=O)n(CC3CC3)c2c1)C#N)[C@@H]1CNCCCO1 Show InChI InChI=1S/C26H28N4O4/c27-14-21(29-25(31)24-15-28-10-1-11-33-24)12-17-4-6-19(7-5-17)20-8-9-23-22(13-20)30(26(32)34-23)16-18-2-3-18/h4-9,13,18,21,24,28H,1-3,10-12,15-16H2,(H,29,31)/t21-,24-/m0/s1	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	6.31	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