BDBM50135277 CHEMBL3746635

SMILES: CC(C)C[C@H](NC(C)=O)C(=O)N[C@H](CCCNC(N)=N)C(=O)c1ccccc1

InChI Key: InChIKey=BTNDVCPNWVRRHA-SJORKVTESA-N

Data: 2 KI

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 2 hits for monomerid = 50135277   

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
Suppressor of tumorigenicity 14 protein homolog (Mus musculus)	BDBM50135277 (CHEMBL3746635) Show SMILES CC(C)C[C@H](NC(C)=O)C(=O)N[C@H](CCCNC(N)=N)C(=O)c1ccccc1 |r| Show InChI InChI=1S/C20H31N5O3/c1-13(2)12-17(24-14(3)26)19(28)25-16(10-7-11-23-20(21)22)18(27)15-8-5-4-6-9-15/h4-6,8-9,13,16-17H,7,10-12H2,1-3H3,(H,24,26)(H,25,28)(H4,21,22,23)/t16-,17+/m1/s1	PDB UniProtKB/SwissProt UniProtKB/TrEMBL GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Korea University Curated by ChEMBL					Assay Description Inhibition of mouse recombinant matriptase using Boc-QAR-AMC as substrate preincubated for 30 mins followed by substrate addition measured for 15 to ...				Bioorg Med Chem Lett 26: 310-4 (2016) BindingDB Entry DOI: 10.7270/Q2NP267S
					More data for this Ligand-Target Pair
Hepsin (Homo sapiens (Human))	BDBM50135277 (CHEMBL3746635) Show SMILES CC(C)C[C@H](NC(C)=O)C(=O)N[C@H](CCCNC(N)=N)C(=O)c1ccccc1 |r| Show InChI InChI=1S/C20H31N5O3/c1-13(2)12-17(24-14(3)26)19(28)25-16(10-7-11-23-20(21)22)18(27)15-8-5-4-6-9-15/h4-6,8-9,13,16-17H,7,10-12H2,1-3H3,(H,24,26)(H,25,28)(H4,21,22,23)/t16-,17+/m1/s1	PDB MMDB KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Korea University Curated by ChEMBL					Assay Description Inhibition of human recombinant hepsin using Boc-QAR-AMC as substrate preincubated for 30 mins followed by substrate addition measured for 15 to 120 ...				Bioorg Med Chem Lett 26: 310-4 (2016) BindingDB Entry DOI: 10.7270/Q2NP267S
					More data for this Ligand-Target Pair