Brief Information of the Compound and Protein
Compound Name
(2S)-2-[[(5R,8S,11S,14S,17S,20R)-11-[3-(diaminomethylideneamino)propyl]-8-(hydroxymethyl)-14-[(4-hydroxyphenyl)methyl]-17-(2-methylpropyl)-7,10,13,16,19-pentaoxo-20-[[(2S)-pyrrolidine-2-carbonyl]amino]-3,22-dithia-6,9,12,15,18,28-hexazabicyclo[22.3.1]octacosa-1(27),24(28),25-triene-5-carbonyl]amino]-3-hydroxypropanoic acid
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PubChem ID
CID: 168274138
Canonical SMILES
CC(C)C[C@@H]1NC(=O)[C@H](CSCc2cccc(CSC[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](Cc3ccc(O)cc3)NC1=O)C(=O)N[C@@H](CO)C(O)=O)n2)NC(=O)[C@@H]1CCCN1
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Compound Formula C45H66N12O12S2
Compound Structure
Protein Name
Kallikrein-7
Protein Classification
Enzyme
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Protease
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Serine protease
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Serine protease PA clan
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Serine protease S1A subfamily
Uniprot ID
P49862
Gene Name
KLK7
Table of Molecular Bioactivities Related to the Compound and Protein
Cell-based Assay
Cell Line ID Cell Line Name Cell Line Organism
CL000011 CHO Cricetulus griseus (Chinese hamster)  1
1
Ki = 53 nM
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