BDBM50339250 (Z/E)-(S)-2-((5-chloro-2-oxoindolin-3-ylidene)methylamino)-N-isopentyl-3-phenylpropanamide::CHEMBL1689610

SMILES: CC(C)CCNC(=O)[C@H](Cc1ccccc1)N=CC1C(=O)Nc2ccc(Cl)cc12

InChI Key: InChIKey=RNSCKAVEDDTXTP-QWAKEFERSA-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 = 50339250   

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
Cysteine protease falcipain-3 (Plasmodium falciparum)	BDBM50339250 ((Z/E)-(S)-2-((5-chloro-2-oxoindolin-3-ylidene)meth...) Show SMILES CC(C)CCNC(=O)[C@H](Cc1ccccc1)N=CC1C(=O)Nc2ccc(Cl)cc12 |r,w:17.18| Show InChI InChI=1S/C23H26ClN3O2/c1-15(2)10-11-25-23(29)21(12-16-6-4-3-5-7-16)26-14-19-18-13-17(24)8-9-20(18)27-22(19)28/h3-9,13-15,19,21H,10-12H2,1-2H3,(H,25,29)(H,27,28)/t19?,21-/m0/s1	PDB MMDB KEGG UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>5.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of Lisbon Curated by ChEMBL					Assay Description Inhibition of Plasmodium falciparum falcipain 3 incubated with compound for 10 mins before addition of 25 uM Z-Leu-Arg-AMC substrate by fluorescence ...				Eur J Med Chem 46: 927-33 (2011) Article DOI: 10.1016/j.ejmech.2011.01.008 BindingDB Entry DOI: 10.7270/Q2ZC8345
					More data for this Ligand-Target Pair
Falcipain-2 (Plasmodium falciparum)	BDBM50339250 ((Z/E)-(S)-2-((5-chloro-2-oxoindolin-3-ylidene)meth...) Show SMILES CC(C)CCNC(=O)[C@H](Cc1ccccc1)N=CC1C(=O)Nc2ccc(Cl)cc12 |r,w:17.18| Show InChI InChI=1S/C23H26ClN3O2/c1-15(2)10-11-25-23(29)21(12-16-6-4-3-5-7-16)26-14-19-18-13-17(24)8-9-20(18)27-22(19)28/h3-9,13-15,19,21H,10-12H2,1-2H3,(H,25,29)(H,27,28)/t19?,21-/m0/s1	PDB MMDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	4.33E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of Lisbon Curated by ChEMBL					Assay Description Inhibition of Plasmodium falciparum falcipain 2 incubated with compound for 10 mins before addition of 25 uM Z-Leu-Arg-AMC substrate by fluorescence ...				Eur J Med Chem 46: 927-33 (2011) Article DOI: 10.1016/j.ejmech.2011.01.008 BindingDB Entry DOI: 10.7270/Q2ZC8345
					More data for this Ligand-Target Pair