Ki Summary BindingDB logo
myBDB logout
Reaction Details
Report a problem with these data
TargetKallikrein-1
LigandBDBM50071572
Substrate/Competitorn/a
Meas. Tech.ChEBML_92390
Ki 21±n/a nM
Citation Ogbu, COQabar, MNBoatman, PDUrban, JMeara, JPFerguson, MDTulinsky, JLum, CBabu, SBlaskovich, MANakanishi, HRuan, FCao, BMinarik, RLittle, TNelson, SNguyen, MGall, AKahn, M Highly efficient and versatile synthesis of libraries of constrained beta-strand mimetics. Bioorg Med Chem Lett8:2321-6 (1999) [PubMed]
More Info.:Get all data from this article,  Assay Method
 
Kallikrein-1
Name:Kallikrein-1
Synonyms:KLK1 | KLK1_HUMAN | Kallikrein 1 | Kallikrein-1 | Kidney/pancreas/salivary gland kallikrein | Tissue kallikrein
Type:Enzyme
Mol. Mass.:28874.69
Organism:Homo sapiens (Human)
Description:P06870
Residue:262
Sequence:
MWFLVLCLALSLGGTGAAPPIQSRIVGGWECEQHSQPWQAALYHFSTFQCGGILVHRQWV
LTAAHCISDNYQLWLGRHNLFDDENTAQFVHVSESFPHPGFNMSLLENHTRQADEDYSHD
LMLLRLTEPADTITDAVKVVELPTEEPEVGSTCLASGWGSIEPENFSFPDDLQCVDLKIL
PNDECKKAHVQKVTDFMLCVGHLEGGKDTCVGDSGGPLMCDGVLQGVTSWGYVPCGTPNK
PSVAVRVLSYVKWIEDTIAENS
Blast this sequence in BindingDB or PDB
  Blast E-value cutoff:
BDBM50071572
n/a
NameBDBM50071572
Synonyms:8-{5-Amino-1-[2-(4-carbamoyl-phenyl)-ethylaminooxalyl]-pentylcarbamoyl}-2-(2,5-difluoro-benzyl)-1,3-dioxo-6-phenethyl-2,3,5,8-tetrahydro-1H-[1,2,4]triazolo[1,2-a]pyridazine-5-carboxylic acid methyl ester | CHEMBL74911
TypeSmall organic molecule
Emp. Form.C40H43F2N7O8
Mol. Mass.787.8083
SMILESCOC(=O)C1C(CCc2ccccc2)=CC(C(=O)NC(CCCCN)C(=O)C(=O)NCCc2ccc(cc2)C(N)=O)n2n1c(=O)n(Cc1cc(F)ccc1F)c2=O |c:14|
Structure
Search PDB for entries with ligand similarity:Similarity to this molecule at least: