BindingDB logo
myBDB logout

BDBM50098244 3-[4-(Amino-hydrazino-methyl)-phenyl]-N-cyclopentyl-N-methyl-2-(5,6,7,8-tetrahydro-naphthalene-1-sulfonylamino)-propionamide::CHEMBL9496

SMILES: CN(C1CCCC1)C(=O)[C@H](Cc1ccc(cc1)C(N)NN)NS(=O)(=O)c1cccc2CCCCc12

InChI Key: InChIKey=ONJLSAIQNJJWTH-LFQPHHBNSA-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 = 50098244   
Target/Host
(Institution)		LigandTarget/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		pHTemp
°C
Prothrombin


(Homo sapiens (Human))		BDBM50098244
PNG
(3-[4-(Amino-hydrazino-methyl)-phenyl]-N-cyclopenty...)
Show SMILES CN(C1CCCC1)C(=O)[C@H](Cc1ccc(cc1)C(N)NN)NS(=O)(=O)c1cccc2CCCCc12
Show InChI InChI=1S/C26H37N5O3S/c1-31(21-9-3-4-10-21)26(32)23(17-18-13-15-20(16-14-18)25(27)29-28)30-35(33,34)24-12-6-8-19-7-2-5-11-22(19)24/h6,8,12-16,21,23,25,29-30H,2-5,7,9-11,17,27-28H2,1H3/t23-,25?/m0/s1
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars
PubMed
 3.80n/an/an/an/an/an/an/an/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