Molecule Details
InChIKeyGAYYBAJBQWLHKS-KRWDZBQOSA-N
Compound Name2-[4-(2,4-Diamino-7,8-dihydro-5H-1,3,6,9-tetraaza-anthracen-6-ylmethyl)-benzoylamino]-pentanedioic acid
Canonical SMILESNc1nc(N)c2cc3c(nc2n1)CCN(Cc1ccc(C(=O)N[C@@H](CCC(=O)O)C(=O)O)cc1)C3
Clinical Status Data-mined Candidate
Targets (Human+Pathogen)3
Pfam Stratification Homologous
Avg pChEMBL6.05
SourceBindingDB;ChEMBL
2D Structure
2D structure
Activity Profile
Target Activities (3)
Target Gene Organism Category Pfam pChEMBL Type Source
B0BL08 dfrA17 Escherichia coli Pathogen PF00186 6.0 IC50 BindingDB
P0ABQ4 folA Escherichia coli (strain K12) Pathogen PF00186 6.0 IC50 ChEMBL
Q07422 Toxoplasma gondii Pathogen PF00186 PF00303 6.0 IC50 ChEMBL;BindingDB