BDBM50142180 5-Chloro-N-(5-chloro-pyridin-2-yl)-2-[4-(2-imino-[1,3]diazepan-1-ylmethyl)-benzoylamino]-benzamide::CHEMBL174731

SMILES: NC1=NCCCCN1Cc1ccc(cc1)C(=O)Nc1ccc(Cl)cc1C(=O)Nc1ccc(Cl)cn1

InChI Key: InChIKey=MGQKPZVSWAKTTK-UHFFFAOYSA-N

Data: 6 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 6 hits for monomerid = 50142180   

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
Vitamin K-dependent protein C (Homo sapiens (Human))	BDBM50142180 (5-Chloro-N-(5-chloro-pyridin-2-yl)-2-[4-(2-imino-[...) Show SMILES NC1=NCCCCN1Cc1ccc(cc1)C(=O)Nc1ccc(Cl)cc1C(=O)Nc1ccc(Cl)cn1 |t:1| Show InChI InChI=1S/C25H24Cl2N6O2/c26-18-7-9-21(20(13-18)24(35)32-22-10-8-19(27)14-30-22)31-23(34)17-5-3-16(4-6-17)15-33-12-2-1-11-29-25(33)28/h3-10,13-14H,1-2,11-12,15H2,(H2,28,29)(H,31,34)(H,30,32,35)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>1.10E+4	n/a	n/a	n/a	n/a	n/a	n/a
Millennium Pharmaceuticals, Inc. Curated by ChEMBL					Assay Description Inhibitory activity against activated protein C				Bioorg Med Chem Lett 14: 989-93 (2004) Article DOI: 10.1016/j.bmcl.2003.11.080 BindingDB Entry DOI: 10.7270/Q2X34WXD
					More data for this Ligand-Target Pair
Coagulation factor X (Homo sapiens (Human))	BDBM50142180 (5-Chloro-N-(5-chloro-pyridin-2-yl)-2-[4-(2-imino-[...) Show SMILES NC1=NCCCCN1Cc1ccc(cc1)C(=O)Nc1ccc(Cl)cc1C(=O)Nc1ccc(Cl)cn1 |t:1| Show InChI InChI=1S/C25H24Cl2N6O2/c26-18-7-9-21(20(13-18)24(35)32-22-10-8-19(27)14-30-22)31-23(34)17-5-3-16(4-6-17)15-33-12-2-1-11-29-25(33)28/h3-10,13-14H,1-2,11-12,15H2,(H2,28,29)(H,31,34)(H,30,32,35)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	6.30	n/a	n/a	n/a	n/a	n/a	n/a
Millennium Pharmaceuticals, Inc. Curated by ChEMBL					Assay Description In vitro inhibitory activity against coagulation factor X.				Bioorg Med Chem Lett 14: 989-93 (2004) Article DOI: 10.1016/j.bmcl.2003.11.080 BindingDB Entry DOI: 10.7270/Q2X34WXD
					More data for this Ligand-Target Pair
Prothrombin (Homo sapiens (Human))	BDBM50142180 (5-Chloro-N-(5-chloro-pyridin-2-yl)-2-[4-(2-imino-[...) Show SMILES NC1=NCCCCN1Cc1ccc(cc1)C(=O)Nc1ccc(Cl)cc1C(=O)Nc1ccc(Cl)cn1 |t:1| Show InChI InChI=1S/C25H24Cl2N6O2/c26-18-7-9-21(20(13-18)24(35)32-22-10-8-19(27)14-30-22)31-23(34)17-5-3-16(4-6-17)15-33-12-2-1-11-29-25(33)28/h3-10,13-14H,1-2,11-12,15H2,(H2,28,29)(H,31,34)(H,30,32,35)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>1.10E+4	n/a	n/a	n/a	n/a	n/a	n/a
Millennium Pharmaceuticals, Inc. Curated by ChEMBL					Assay Description Inhibitory activity against thrombin.				Bioorg Med Chem Lett 14: 989-93 (2004) Article DOI: 10.1016/j.bmcl.2003.11.080 BindingDB Entry DOI: 10.7270/Q2X34WXD
					More data for this Ligand-Target Pair
Trypsin-1 (Homo sapiens (Human))	BDBM50142180 (5-Chloro-N-(5-chloro-pyridin-2-yl)-2-[4-(2-imino-[...) Show SMILES NC1=NCCCCN1Cc1ccc(cc1)C(=O)Nc1ccc(Cl)cc1C(=O)Nc1ccc(Cl)cn1 |t:1| Show InChI InChI=1S/C25H24Cl2N6O2/c26-18-7-9-21(20(13-18)24(35)32-22-10-8-19(27)14-30-22)31-23(34)17-5-3-16(4-6-17)15-33-12-2-1-11-29-25(33)28/h3-10,13-14H,1-2,11-12,15H2,(H2,28,29)(H,31,34)(H,30,32,35)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>1.10E+4	n/a	n/a	n/a	n/a	n/a	n/a
Millennium Pharmaceuticals, Inc. Curated by ChEMBL					Assay Description Inhibitory activity against trypsin.				Bioorg Med Chem Lett 14: 989-93 (2004) Article DOI: 10.1016/j.bmcl.2003.11.080 BindingDB Entry DOI: 10.7270/Q2X34WXD
					More data for this Ligand-Target Pair
Plasminogen (Homo sapiens (Human))	BDBM50142180 (5-Chloro-N-(5-chloro-pyridin-2-yl)-2-[4-(2-imino-[...) Show SMILES NC1=NCCCCN1Cc1ccc(cc1)C(=O)Nc1ccc(Cl)cc1C(=O)Nc1ccc(Cl)cn1 |t:1| Show InChI InChI=1S/C25H24Cl2N6O2/c26-18-7-9-21(20(13-18)24(35)32-22-10-8-19(27)14-30-22)31-23(34)17-5-3-16(4-6-17)15-33-12-2-1-11-29-25(33)28/h3-10,13-14H,1-2,11-12,15H2,(H2,28,29)(H,31,34)(H,30,32,35)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>1.10E+4	n/a	n/a	n/a	n/a	n/a	n/a
Millennium Pharmaceuticals, Inc. Curated by ChEMBL					Assay Description Inhibitory activity against plasmin.				Bioorg Med Chem Lett 14: 989-93 (2004) Article DOI: 10.1016/j.bmcl.2003.11.080 BindingDB Entry DOI: 10.7270/Q2X34WXD
					More data for this Ligand-Target Pair
Tissue-type plasminogen activator (Homo sapiens (Human))	BDBM50142180 (5-Chloro-N-(5-chloro-pyridin-2-yl)-2-[4-(2-imino-[...) Show SMILES NC1=NCCCCN1Cc1ccc(cc1)C(=O)Nc1ccc(Cl)cc1C(=O)Nc1ccc(Cl)cn1 |t:1| Show InChI InChI=1S/C25H24Cl2N6O2/c26-18-7-9-21(20(13-18)24(35)32-22-10-8-19(27)14-30-22)31-23(34)17-5-3-16(4-6-17)15-33-12-2-1-11-29-25(33)28/h3-10,13-14H,1-2,11-12,15H2,(H2,28,29)(H,31,34)(H,30,32,35)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>1.10E+4	n/a	n/a	n/a	n/a	n/a	n/a
Millennium Pharmaceuticals, Inc. Curated by ChEMBL					Assay Description Inhibitory activity against tissue type plasminogen activator.				Bioorg Med Chem Lett 14: 989-93 (2004) Article DOI: 10.1016/j.bmcl.2003.11.080 BindingDB Entry DOI: 10.7270/Q2X34WXD
					More data for this Ligand-Target Pair