BDBM50098233 CHEMBL9461::Naphthalene-2-sulfonic acid [1-[4-(amino-hydrazino-methyl)-benzyl]-2-(4-methanesulfonyl-piperazin-1-yl)-2-oxo-ethyl]-amide

SMILES: CS(=O)(=O)N1CCN(CC1)C(=O)[C@H](Cc1ccc(cc1)C(N)NN)NS(=O)(=O)c1ccc2ccccc2c1

InChI Key: InChIKey=MEYHMWACLXVUJU-UXMRNZNESA-N

Data: 1 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 1 hit for monomerid = 50098233   

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))	BDBM50098233 (CHEMBL9461 | Naphthalene-2-sulfonic acid [1-[4-(am...) Show SMILES CS(=O)(=O)N1CCN(CC1)C(=O)[C@H](Cc1ccc(cc1)C(N)NN)NS(=O)(=O)c1ccc2ccccc2c1 Show InChI InChI=1S/C25H32N6O5S2/c1-37(33,34)31-14-12-30(13-15-31)25(32)23(16-18-6-8-20(9-7-18)24(26)28-27)29-38(35,36)22-11-10-19-4-2-3-5-21(19)17-22/h2-11,17,23-24,28-29H,12-16,26-27H2,1H3/t23-,24?/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	11	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Yale University Curated by ChEMBL					Assay Description Binding affinity was determined against human thrombin				J Med Chem 44: 1043-50 (2001) BindingDB Entry DOI: 10.7270/Q2KS6S86
					More data for this Ligand-Target Pair