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Reaction Details
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TargetSerine protease 1
LigandBDBM50289530
Substrate/Competitorn/a
Meas. Tech.ChEBML_212727
Ki 2100±n/a nM
Citation Sanderson, PEDyer, DLNaylor-Olsen, AMVacca, JPGardell, SJDale Lewis, SLucas, BJLyle, EALynch, JJMulichak, AM L-373,890, An achiral, noncovalent, subnanomolar thrombin inhibitor Bioorg Med Chem Lett7:1497-1500 (1997)    Article
More Info.:Get all data from this article,  Assay Method
 
Serine protease 1
Name:Serine protease 1
Synonyms:Alpha-trypsin chain 1 | Alpha-trypsin chain 2 | Beta-trypsin | Cationic trypsinogen | PRSS1 | Serine protease 1 | TRP1 | TRY1 | TRY1_HUMAN | TRYP1 | Thrombin & trypsin | Trypsin | Trypsin I | Trypsin-1
Type:Enzyme
Mol. Mass.:26557.80
Organism:Homo sapiens (Human)
Description:P07477
Residue:247
Sequence:
MNPLLILTFVAAALAAPFDDDDKIVGGYNCEENSVPYQVSLNSGYHFCGGSLINEQWVVS
AGHCYKSRIQVRLGEHNIEVLEGNEQFINAAKIIRHPQYDRKTLNNDIMLIKLSSRAVIN
ARVSTISLPTAPPATGTKCLISGWGNTASSGADYPDELQCLDAPVLSQAKCEASYPGKIT
SNMFCVGFLEGGKDSCQGDSGGPVVCNGQLQGVVSWGDGCAQKNKPGVYTKVYNYVKWIK
NTIAANS
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  Blast E-value cutoff:
BDBM50289530
n/a
NameBDBM50289530
Synonyms:CHEMBL3085115 | N-(4-Amino-cyclohexylmethyl)-2-[6-methyl-2-oxo-3-(toluene-4-sulfonylamino)-2H-pyridin-1-yl]-acetamide
TypeSmall organic molecule
Emp. Form.C22H30N4O4S
Mol. Mass.446.563
SMILESCc1ccc(cc1)S(=O)(=O)Nc1ccc(C)n(CC(=O)NC[C@H]2CC[C@H](N)CC2)c1=O |wU:22.22,wD:25.26,(-7.05,-12.41,;-5.72,-11.62,;-5.72,-10.08,;-4.37,-9.31,;-3.04,-10.09,;-3.07,-11.62,;-4.37,-12.4,;-1.71,-9.31,;-.62,-8.22,;-2.8,-8.22,;-.38,-10.09,;.94,-9.31,;.94,-7.77,;2.27,-7,;3.63,-7.77,;4.95,-6.98,;3.63,-9.31,;4.95,-10.09,;4.95,-11.62,;6.28,-12.39,;3.63,-12.4,;4.02,-13.89,;5.5,-14.28,;6.59,-13.19,;8.07,-13.61,;8.46,-15.1,;9.95,-15.5,;7.37,-16.18,;5.89,-15.78,;2.27,-10.09,;2.27,-11.62,)|
Structure
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