BDBM50093147 CHEMBL79545::Pentanedioic acid 4-guanidino-benzylamide 4-{[4-(4-guanidino-benzylcarbamoyl)-butyrylamino]-methyl}-benzylamide

SMILES: [#7]\[#6](-[#7])=[#7]/c1ccc(-[#6]-[#7]-[#6](=O)-[#6]-[#6]-[#6]-[#6](=O)-[#7]-[#6]-c2ccc(-[#6]-[#7]-[#6](=O)-[#6]-[#6]-[#6]-[#6](=O)-[#7]-[#6]-c3ccc(cc3)\[#7]=[#6](/[#7])-[#7])cc2)cc1

InChI Key: InChIKey=MQFPKMGNYBQKII-UHFFFAOYSA-N

Data: 4 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 4 hits for monomerid = 50093147   

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
Tryptase (Homo sapiens (Human))	BDBM50093147 (CHEMBL79545 | Pentanedioic acid 4-guanidino-benzyl...) Show SMILES [#7]\[#6](-[#7])=[#7]/c1ccc(-[#6]-[#7]-[#6](=O)-[#6]-[#6]-[#6]-[#6](=O)-[#7]-[#6]-c2ccc(-[#6]-[#7]-[#6](=O)-[#6]-[#6]-[#6]-[#6](=O)-[#7]-[#6]-c3ccc(cc3)\[#7]=[#6](/[#7])-[#7])cc2)cc1 Show InChI InChI=1S/C34H44N10O4/c35-33(36)43-27-15-11-25(12-16-27)21-41-31(47)5-1-3-29(45)39-19-23-7-9-24(10-8-23)20-40-30(46)4-2-6-32(48)42-22-26-13-17-28(18-14-26)44-34(37)38/h7-18H,1-6,19-22H2,(H,39,45)(H,40,46)(H,41,47)(H,42,48)(H4,35,36,43)(H4,37,38,44)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	100	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Axys Pharmaceuticals, Inc. Curated by ChEMBL					Assay Description Inhibitory potency against tryptase				Bioorg Med Chem Lett 10: 2357-60 (2001) BindingDB Entry DOI: 10.7270/Q2NP23NX
					More data for this Ligand-Target Pair
Trypsin-1 (Homo sapiens (Human))	BDBM50093147 (CHEMBL79545 | Pentanedioic acid 4-guanidino-benzyl...) Show SMILES [#7]\[#6](-[#7])=[#7]/c1ccc(-[#6]-[#7]-[#6](=O)-[#6]-[#6]-[#6]-[#6](=O)-[#7]-[#6]-c2ccc(-[#6]-[#7]-[#6](=O)-[#6]-[#6]-[#6]-[#6](=O)-[#7]-[#6]-c3ccc(cc3)\[#7]=[#6](/[#7])-[#7])cc2)cc1 Show InChI InChI=1S/C34H44N10O4/c35-33(36)43-27-15-11-25(12-16-27)21-41-31(47)5-1-3-29(45)39-19-23-7-9-24(10-8-23)20-40-30(46)4-2-6-32(48)42-22-26-13-17-28(18-14-26)44-34(37)38/h7-18H,1-6,19-22H2,(H,39,45)(H,40,46)(H,41,47)(H,42,48)(H4,35,36,43)(H4,37,38,44)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	7.00E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Axys Pharmaceuticals, Inc. Curated by ChEMBL					Assay Description Inhibitory potency against trypsin				Bioorg Med Chem Lett 10: 2357-60 (2001) BindingDB Entry DOI: 10.7270/Q2NP23NX
					More data for this Ligand-Target Pair
Prothrombin (Homo sapiens (Human))	BDBM50093147 (CHEMBL79545 | Pentanedioic acid 4-guanidino-benzyl...) Show SMILES [#7]\[#6](-[#7])=[#7]/c1ccc(-[#6]-[#7]-[#6](=O)-[#6]-[#6]-[#6]-[#6](=O)-[#7]-[#6]-c2ccc(-[#6]-[#7]-[#6](=O)-[#6]-[#6]-[#6]-[#6](=O)-[#7]-[#6]-c3ccc(cc3)\[#7]=[#6](/[#7])-[#7])cc2)cc1 Show InChI InChI=1S/C34H44N10O4/c35-33(36)43-27-15-11-25(12-16-27)21-41-31(47)5-1-3-29(45)39-19-23-7-9-24(10-8-23)20-40-30(46)4-2-6-32(48)42-22-26-13-17-28(18-14-26)44-34(37)38/h7-18H,1-6,19-22H2,(H,39,45)(H,40,46)(H,41,47)(H,42,48)(H4,35,36,43)(H4,37,38,44)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	4.92E+5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Axys Pharmaceuticals, Inc. Curated by ChEMBL					Assay Description Inhibitory potency against thrombin				Bioorg Med Chem Lett 10: 2357-60 (2001) BindingDB Entry DOI: 10.7270/Q2NP23NX
					More data for this Ligand-Target Pair
Plasminogen (Homo sapiens (Human))	BDBM50093147 (CHEMBL79545 | Pentanedioic acid 4-guanidino-benzyl...) Show SMILES [#7]\[#6](-[#7])=[#7]/c1ccc(-[#6]-[#7]-[#6](=O)-[#6]-[#6]-[#6]-[#6](=O)-[#7]-[#6]-c2ccc(-[#6]-[#7]-[#6](=O)-[#6]-[#6]-[#6]-[#6](=O)-[#7]-[#6]-c3ccc(cc3)\[#7]=[#6](/[#7])-[#7])cc2)cc1 Show InChI InChI=1S/C34H44N10O4/c35-33(36)43-27-15-11-25(12-16-27)21-41-31(47)5-1-3-29(45)39-19-23-7-9-24(10-8-23)20-40-30(46)4-2-6-32(48)42-22-26-13-17-28(18-14-26)44-34(37)38/h7-18H,1-6,19-22H2,(H,39,45)(H,40,46)(H,41,47)(H,42,48)(H4,35,36,43)(H4,37,38,44)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	>1.00E+6	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Axys Pharmaceuticals, Inc. Curated by ChEMBL					Assay Description Inhibitory potency against plasmin				Bioorg Med Chem Lett 10: 2357-60 (2001) BindingDB Entry DOI: 10.7270/Q2NP23NX
					More data for this Ligand-Target Pair