Ki Summary BindingDB logo
myBDB logout
Reaction Details
Report a problem with these data
TargetAcrosin
LigandBDBM50424443
Substrate/Competitorn/a
Meas. Tech.ChEMBL_936791 (CHEMBL2320183)
IC50 80000±n/a nM
Citation Chen, QTian, WHan, GQi, JZheng, CZhou, YDing, LZhao, JZhu, JLv, JSheng, C Design and synthesis of novel benzoheterocyclic derivatives as human acrosin inhibitors by scaffold hopping. Eur J Med Chem59:176-82 (2013) [PubMed]  Article
More Info.:Get all data from this article,  Assay Method
 
Acrosin
Name:Acrosin
Synonyms:ACR | ACRO_HUMAN | ACRS
Type:PROTEIN
Mol. Mass.:45865.48
Organism:Homo sapiens (Human)
Description:ChEMBL_1365286
Residue:421
Sequence:
MVEMLPTAILLVLAVSVVAKDNATCDGPCGLRFRQNPQGGVRIVGGKAAQHGAWPWMVSL
QIFTYNSHRYHTCGGSLLNSRWVLTAAHCFVGKNNVHDWRLVFGAKEITYGNNKPVKAPL
QERYVEKIIIHEKYNSATEGNDIALVEITPPISCGRFIGPGCLPHFKAGLPRGSQSCWVA
GWGYIEEKAPRPSSILMEARVDLIDLDLCNSTQWYNGRVQPTNVCAGYPVGKIDTCQGDS
GGPLMCKDSKESAYVVVGITSWGVGCARAKRPGIYTATWPYLNWIASKIGSNALRMIQSA
TPPPPTTRPPPIRPPFSHPISAHLPWYFQPPPRPLPPRPPAAQPRPPPSPPPPPPPPASP
LPPPPPPPPPTPSSTTKLPQGLSFAKRLQQLIEVLKGKTYSDGKNHYDMETTELPELTST
S
Blast this sequence in BindingDB or PDB
  Blast E-value cutoff:
BDBM50424443
n/a
NameBDBM50424443
Synonyms:CHEMBL2316070
TypeSmall organic molecule
Emp. Form.C17H18FN5O4S
Mol. Mass.407.419
SMILESOCCNC(=O)Nc1nc2ccc(cc2[nH]1)S(=O)(=O)NCc1ccccc1F
Structure
Search PDB for entries with ligand similarity:Similarity to this molecule at least: