Molecule Details
InChIKeyICKYKEQZWPNRNE-MHZLTWQESA-N
Compound Name(S)-3-[4-(5-Dimethylamino-naphthalene-1-sulfonyloxy)-phenyl]-2-(6-nitro-naphthalene-1-sulfonylamino)-propionic acid
Canonical SMILESCN(C)c1cccc2c(S(=O)(=O)Oc3ccc(C[C@H](NS(=O)(=O)c4cccc5cc([N+](=O)[O-])ccc45)C(=O)O)cc3)cccc12
Clinical Status Data-mined Candidate
Targets (Human+Pathogen)2
Pfam Stratification Homologous
Avg pChEMBL8.96
SourceChEMBL;BindingDB
2D Structure
2D structure
Activity Profile
Target Activities (2)
Target Gene Organism Category Pfam pChEMBL Type Source
P04818 TYMS Homo sapiens Human PF00303 8.4 Ki ChEMBL;BindingDB
C3SWJ7 thyA Escherichia coli Pathogen PF00303 9.5 Ki ChEMBL;BindingDB