BDBM50082177 1-[3-(3-Carbamimidoyl-phenyl)-2-(2,4,6-triisopropyl-benzenesulfonylamino)-propionyl]-piperidine-2-carboxylic acid methyl ester::CHEMBL105875

SMILES: COC(=O)C1CCCCN1C(=O)C(Cc1cccc(c1)C(N)=N)NS(=O)(=O)c1c(cc(cc1C(C)C)C(C)C)C(C)C

InChI Key: InChIKey=MRGAADDXUCOAJZ-UHFFFAOYSA-N

Data: 3 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 3 hits for monomerid = 50082177   

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
Plasminogen (Homo sapiens (Human))	BDBM50082177 (1-[3-(3-Carbamimidoyl-phenyl)-2-(2,4,6-triisopropy...) Show SMILES COC(=O)C1CCCCN1C(=O)C(Cc1cccc(c1)C(N)=N)NS(=O)(=O)c1c(cc(cc1C(C)C)C(C)C)C(C)C Show InChI InChI=1S/C32H46N4O5S/c1-19(2)24-17-25(20(3)4)29(26(18-24)21(5)6)42(39,40)35-27(16-22-11-10-12-23(15-22)30(33)34)31(37)36-14-9-8-13-28(36)32(38)41-7/h10-12,15,17-21,27-28,35H,8-9,13-14,16H2,1-7H3,(H3,33,34)	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+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universität Jena Curated by ChEMBL					Assay Description Tested for inhibition of plasmin				Bioorg Med Chem Lett 9: 3147-52 (1999) BindingDB Entry DOI: 10.7270/Q2RB73S3
					More data for this Ligand-Target Pair
Trypsin II (Bos taurus)	BDBM50082177 (1-[3-(3-Carbamimidoyl-phenyl)-2-(2,4,6-triisopropy...) Show SMILES COC(=O)C1CCCCN1C(=O)C(Cc1cccc(c1)C(N)=N)NS(=O)(=O)c1c(cc(cc1C(C)C)C(C)C)C(C)C Show InChI InChI=1S/C32H46N4O5S/c1-19(2)24-17-25(20(3)4)29(26(18-24)21(5)6)42(39,40)35-27(16-22-11-10-12-23(15-22)30(33)34)31(37)36-14-9-8-13-28(36)32(38)41-7/h10-12,15,17-21,27-28,35H,8-9,13-14,16H2,1-7H3,(H3,33,34)	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	1.40E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universität Jena Curated by ChEMBL					Assay Description Tested for inhibition of trypsin				Bioorg Med Chem Lett 9: 3147-52 (1999) BindingDB Entry DOI: 10.7270/Q2RB73S3
					More data for this Ligand-Target Pair
Urokinase-type plasminogen activator (Homo sapiens (Human))	BDBM50082177 (1-[3-(3-Carbamimidoyl-phenyl)-2-(2,4,6-triisopropy...) Show SMILES COC(=O)C1CCCCN1C(=O)C(Cc1cccc(c1)C(N)=N)NS(=O)(=O)c1c(cc(cc1C(C)C)C(C)C)C(C)C Show InChI InChI=1S/C32H46N4O5S/c1-19(2)24-17-25(20(3)4)29(26(18-24)21(5)6)42(39,40)35-27(16-22-11-10-12-23(15-22)30(33)34)31(37)36-14-9-8-13-28(36)32(38)41-7/h10-12,15,17-21,27-28,35H,8-9,13-14,16H2,1-7H3,(H3,33,34)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	3.30E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universität Jena Curated by ChEMBL					Assay Description Tested for inhibition of plasminogen activator urokinase (microPa)				Bioorg Med Chem Lett 9: 3147-52 (1999) BindingDB Entry DOI: 10.7270/Q2RB73S3
					More data for this Ligand-Target Pair