BDBM50502830 CHEMBL4535973

SMILES: FC(F)(F)[C@@H](N[C@H](Cc1c[nH]c2ccccc12)C(=O)NC1(CC1)C#N)c1ccccc1

InChI Key: InChIKey=RNJSOOXYHVOLCF-UXHICEINSA-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 = 50502830   

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
Procathepsin L (Homo sapiens (Human))	BDBM50502830 (CHEMBL4535973) Show SMILES FC(F)(F)[C@@H](N[C@H](Cc1c[nH]c2ccccc12)C(=O)NC1(CC1)C#N)c1ccccc1 |r| Show InChI InChI=1S/C23H21F3N4O/c24-23(25,26)20(15-6-2-1-3-7-15)29-19(21(31)30-22(14-27)10-11-22)12-16-13-28-18-9-5-4-8-17(16)18/h1-9,13,19-20,28-29H,10-12H2,(H,30,31)/t19-,20+/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	1.26E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universidade de S£o Paulo Curated by ChEMBL					Assay Description Inhibition of Cathepsin L (unknown origin) using Z-Phe-Arg-7-amido-4-methylcoumarin as substrate preincubated for 2 mins followed by susbtrate additi...				Bioorg Med Chem 27: (2019) Article DOI: 10.1016/j.bmc.2019.115083
					More data for this Ligand-Target Pair
Cruzipain (Trypanosoma cruzi)	BDBM50502830 (CHEMBL4535973) Show SMILES FC(F)(F)[C@@H](N[C@H](Cc1c[nH]c2ccccc12)C(=O)NC1(CC1)C#N)c1ccccc1 |r| Show InChI InChI=1S/C23H21F3N4O/c24-23(25,26)20(15-6-2-1-3-7-15)29-19(21(31)30-22(14-27)10-11-22)12-16-13-28-18-9-5-4-8-17(16)18/h1-9,13,19-20,28-29H,10-12H2,(H,30,31)/t19-,20+/m1/s1	PDB MMDB UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	<1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universidade de S£o Paulo Curated by ChEMBL					Assay Description Inhibition of Trypanosoma cruzi cruzain using Z-Phe-Arg-7-amido-4-methylcoumarin as substrate preincubated for 2 mins followed by susbtrate addition ...				Bioorg Med Chem 27: (2019) Article DOI: 10.1016/j.bmc.2019.115083
					More data for this Ligand-Target Pair