BDBM50366498 CHEMBL1790165

SMILES: [#6]-[#6]-[#6@H](-[#6])-[#6@H](-[#7]-[#6](=O)-[#6@H](-[#6]-[#6]-[#6]\[#7]=[#6](/[#7])-[#7])-[#7]-[#6](=O)-[#8]-[#6]-c1ccccc1)-[#6](=O)-[#7]-[#6@H](-[#6]-[#6]=O)-[#6]-c1ccccc1

InChI Key: InChIKey=JUBVWCCZSZVBDN-QUKDMSEQSA-N

Data: 1 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 1 hit for monomerid = 50366498   

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
Papain (Carica papaya)	BDBM50366498 (CHEMBL1790165) Show SMILES [#6]-[#6]-[#6@H](-[#6])-[#6@H](-[#7]-[#6](=O)-[#6@H](-[#6]-[#6]-[#6]\[#7]=[#6](/[#7])-[#7])-[#7]-[#6](=O)-[#8]-[#6]-c1ccccc1)-[#6](=O)-[#7]-[#6@H](-[#6]-[#6]=O)-[#6]-c1ccccc1 Show InChI InChI=1S/C30H42N6O5/c1-3-21(2)26(28(39)34-24(16-18-37)19-22-11-6-4-7-12-22)36-27(38)25(15-10-17-33-29(31)32)35-30(40)41-20-23-13-8-5-9-14-23/h4-9,11-14,18,21,24-26H,3,10,15-17,19-20H2,1-2H3,(H,34,39)(H,35,40)(H,36,38)(H4,31,32,33)/t21-,24+,25-,26-/m0/s1	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	6.50E+4	n/a	n/a	n/a	n/a	n/a	n/a
Institute for Drug Research Curated by ChEMBL					Assay Description Ability to inhibit papain was evaluated by amidolytic method using fluorogenic or chromogenic substrates				Bioorg Med Chem Lett 8: 1477-82 (1999) Checked by Author BindingDB Entry DOI: 10.7270/Q2GB24KF
					More data for this Ligand-Target Pair