Marvin 2D Structure

The following exact ligands are found in BindingDB

Wt: 614.7 BDBM50257667

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB (change energy unit to kcal/mol)

Found 5 hits in this display   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kJ/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Suppressor of tumorigenicity 14 protein (Homo sapiens (Human))	BDBM50257667 ((S)-4-(4-(2-(3-(3-aminopropanamido)phenylsulfonami...) Show SMILES CNC(=O)CCC(=O)N1CCN(CC1)C(=O)[C@H](Cc1cccc(c1)C(N)=N)NS(=O)(=O)c1cccc(NC(=O)CCN)c1 |r| Show InChI InChI=1S/C28H38N8O6S/c1-32-24(37)8-9-26(39)35-12-14-36(15-13-35)28(40)23(17-19-4-2-5-20(16-19)27(30)31)34-43(41,42)22-7-3-6-21(18-22)33-25(38)10-11-29/h2-7,16,18,23,34H,8-15,17,29H2,1H3,(H3,30,31)(H,32,37)(H,33,38)/t23-/m0/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	53	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
The Medicines Company (Leipzig) GmbH Curated by ChEMBL					Assay Description Inhibition of matriptase (unknown origin)				Bioorg Med Chem Lett 19: 1960-5 (2009) Article DOI: 10.1016/j.bmcl.2009.02.047 BindingDB Entry DOI: 10.7270/Q2J96681
					More data for this Ligand-Target Pair
Plasminogen (Homo sapiens (Human))	BDBM50257667 ((S)-4-(4-(2-(3-(3-aminopropanamido)phenylsulfonami...) Show SMILES CNC(=O)CCC(=O)N1CCN(CC1)C(=O)[C@H](Cc1cccc(c1)C(N)=N)NS(=O)(=O)c1cccc(NC(=O)CCN)c1 |r| Show InChI InChI=1S/C28H38N8O6S/c1-32-24(37)8-9-26(39)35-12-14-36(15-13-35)28(40)23(17-19-4-2-5-20(16-19)27(30)31)34-43(41,42)22-7-3-6-21(18-22)33-25(38)10-11-29/h2-7,16,18,23,34H,8-15,17,29H2,1H3,(H3,30,31)(H,32,37)(H,33,38)/t23-/m0/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	3.60E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
The Medicines Company (Leipzig) GmbH Curated by ChEMBL					Assay Description Inhibition of plasmin (unknown origin)				Bioorg Med Chem Lett 19: 1960-5 (2009) Article DOI: 10.1016/j.bmcl.2009.02.047 BindingDB Entry DOI: 10.7270/Q2J96681
					More data for this Ligand-Target Pair
Urokinase-type plasminogen activator (Homo sapiens (Human))	BDBM50257667 ((S)-4-(4-(2-(3-(3-aminopropanamido)phenylsulfonami...) Show SMILES CNC(=O)CCC(=O)N1CCN(CC1)C(=O)[C@H](Cc1cccc(c1)C(N)=N)NS(=O)(=O)c1cccc(NC(=O)CCN)c1 |r| Show InChI InChI=1S/C28H38N8O6S/c1-32-24(37)8-9-26(39)35-12-14-36(15-13-35)28(40)23(17-19-4-2-5-20(16-19)27(30)31)34-43(41,42)22-7-3-6-21(18-22)33-25(38)10-11-29/h2-7,16,18,23,34H,8-15,17,29H2,1H3,(H3,30,31)(H,32,37)(H,33,38)/t23-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	1.69E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
The Medicines Company (Leipzig) GmbH Curated by ChEMBL					Assay Description Inhibition of uPA (unknown origin)				Bioorg Med Chem Lett 19: 1960-5 (2009) Article DOI: 10.1016/j.bmcl.2009.02.047 BindingDB Entry DOI: 10.7270/Q2J96681
					More data for this Ligand-Target Pair
Prothrombin (Homo sapiens (Human))	BDBM50257667 ((S)-4-(4-(2-(3-(3-aminopropanamido)phenylsulfonami...) Show SMILES CNC(=O)CCC(=O)N1CCN(CC1)C(=O)[C@H](Cc1cccc(c1)C(N)=N)NS(=O)(=O)c1cccc(NC(=O)CCN)c1 |r| Show InChI InChI=1S/C28H38N8O6S/c1-32-24(37)8-9-26(39)35-12-14-36(15-13-35)28(40)23(17-19-4-2-5-20(16-19)27(30)31)34-43(41,42)22-7-3-6-21(18-22)33-25(38)10-11-29/h2-7,16,18,23,34H,8-15,17,29H2,1H3,(H3,30,31)(H,32,37)(H,33,38)/t23-/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	2.90E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
The Medicines Company (Leipzig) GmbH Curated by ChEMBL					Assay Description Inhibition of thrombin (unknown origin)				Bioorg Med Chem Lett 19: 1960-5 (2009) Article DOI: 10.1016/j.bmcl.2009.02.047 BindingDB Entry DOI: 10.7270/Q2J96681
					More data for this Ligand-Target Pair
Coagulation factor X (Homo sapiens (Human))	BDBM50257667 ((S)-4-(4-(2-(3-(3-aminopropanamido)phenylsulfonami...) Show SMILES CNC(=O)CCC(=O)N1CCN(CC1)C(=O)[C@H](Cc1cccc(c1)C(N)=N)NS(=O)(=O)c1cccc(NC(=O)CCN)c1 |r| Show InChI InChI=1S/C28H38N8O6S/c1-32-24(37)8-9-26(39)35-12-14-36(15-13-35)28(40)23(17-19-4-2-5-20(16-19)27(30)31)34-43(41,42)22-7-3-6-21(18-22)33-25(38)10-11-29/h2-7,16,18,23,34H,8-15,17,29H2,1H3,(H3,30,31)(H,32,37)(H,33,38)/t23-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	4.40E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
The Medicines Company (Leipzig) GmbH Curated by ChEMBL					Assay Description Inhibition of factor 10a (unknown origin)				Bioorg Med Chem Lett 19: 1960-5 (2009) Article DOI: 10.1016/j.bmcl.2009.02.047 BindingDB Entry DOI: 10.7270/Q2J96681
					More data for this Ligand-Target Pair