BDBM193318 US9199927, 29

SMILES: NC(=N)Nc1ccc(cc1)C(=O)Oc1ccc(CC(=O)N[C@@H](Cc2ccccc2F)C(O)=O)c(Cl)c1

InChI Key: InChIKey=RGJDZBCLNWPAAV-NRFANRHFSA-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 2 hits for monomerid = 193318   

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
Trypsin (Mus musculus (Mouse))	BDBM193318 (US9199927, 29) Show SMILES NC(=N)Nc1ccc(cc1)C(=O)Oc1ccc(CC(=O)N[C@@H](Cc2ccccc2F)C(O)=O)c(Cl)c1 |r| Show InChI InChI=1S/C25H22ClFN4O5/c26-19-13-18(36-24(35)14-5-8-17(9-6-14)30-25(28)29)10-7-15(19)12-22(32)31-21(23(33)34)11-16-3-1-2-4-20(16)27/h1-10,13,21H,11-12H2,(H,31,32)(H,33,34)(H4,28,29,30)/t21-/m0/s1	PDB GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	0.210	n/a	n/a	n/a	n/a	8.0	25
Astellas Pharma Inc. US Patent					Assay Description The compound was dissolved in dimethyl sulfoxide (DMSO), and diluted to an arbitrary concentration (A). A was 100-fold diluted with a buffer (0.1 M T...				US Patent US9199927 (2015) BindingDB Entry DOI: 10.7270/Q2P26WXN
					More data for this Ligand-Target Pair
Trypsin-1 (Homo sapiens (Human))	BDBM193318 (US9199927, 29) Show SMILES NC(=N)Nc1ccc(cc1)C(=O)Oc1ccc(CC(=O)N[C@@H](Cc2ccccc2F)C(O)=O)c(Cl)c1 |r| Show InChI InChI=1S/C25H22ClFN4O5/c26-19-13-18(36-24(35)14-5-8-17(9-6-14)30-25(28)29)10-7-15(19)12-22(32)31-21(23(33)34)11-16-3-1-2-4-20(16)27/h1-10,13,21H,11-12H2,(H,31,32)(H,33,34)(H4,28,29,30)/t21-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	0.310	n/a	n/a	n/a	n/a	8.0	25
Astellas Pharma Inc. US Patent					Assay Description The compound was dissolved in dimethyl sulfoxide (DMSO), and diluted to an arbitrary concentration (A). A was 100-fold diluted with a buffer (0.1 M T...				US Patent US9199927 (2015) BindingDB Entry DOI: 10.7270/Q2P26WXN
					More data for this Ligand-Target Pair