BDBM50289528 CHEMBL36397::N-(1-Carbamimidoyl-piperidin-4-ylmethyl)-2-[6-methyl-2-oxo-3-(toluene-4-sulfonylamino)-2H-pyridin-1-yl]-acetamide

SMILES: Cc1ccc(cc1)S(=O)(=O)Nc1ccc(C)n(CC(=O)NCC2CCN(CC2)C(N)=N)c1=O

InChI Key: InChIKey=FYBMKIHEKBWKGO-UHFFFAOYSA-N

Data: 2 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 2 hits for monomerid = 50289528   

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
Prothrombin (Homo sapiens (Human))	BDBM50289528 (CHEMBL36397 | N-(1-Carbamimidoyl-piperidin-4-ylmet...) Show SMILES Cc1ccc(cc1)S(=O)(=O)Nc1ccc(C)n(CC(=O)NCC2CCN(CC2)C(N)=N)c1=O Show InChI InChI=1S/C22H30N6O4S/c1-15-3-6-18(7-4-15)33(31,32)26-19-8-5-16(2)28(21(19)30)14-20(29)25-13-17-9-11-27(12-10-17)22(23)24/h3-8,17,26H,9-14H2,1-2H3,(H3,23,24)(H,25,29)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article	29	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Binding affinity against human thrombin				Bioorg Med Chem Lett 7: 1497-1500 (1997) Article DOI: 10.1016/S0960-894X(97)00257-6 BindingDB Entry DOI: 10.7270/Q2P55P15
					More data for this Ligand-Target Pair
Serine protease 1 (Homo sapiens (Human))	BDBM50289528 (CHEMBL36397 | N-(1-Carbamimidoyl-piperidin-4-ylmet...) Show SMILES Cc1ccc(cc1)S(=O)(=O)Nc1ccc(C)n(CC(=O)NCC2CCN(CC2)C(N)=N)c1=O Show InChI InChI=1S/C22H30N6O4S/c1-15-3-6-18(7-4-15)33(31,32)26-19-8-5-16(2)28(21(19)30)14-20(29)25-13-17-9-11-27(12-10-17)22(23)24/h3-8,17,26H,9-14H2,1-2H3,(H3,23,24)(H,25,29)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article	140	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Binding affinity against human trypsin				Bioorg Med Chem Lett 7: 1497-1500 (1997) Article DOI: 10.1016/S0960-894X(97)00257-6 BindingDB Entry DOI: 10.7270/Q2P55P15
					More data for this Ligand-Target Pair