zelatriazin (TAK-041)


SMILES O=c1c2c(nnn1CC(=O)N[C@@H](C)c1ccc(cc1)OC(F)(F)F)cccc2
InChIKey JZGLECLGVQRPPI-NSHDSACASA-N

Chemical properties

Hydrogen bond acceptors 6
Hydrogen bond donors 1
Rotatable bonds 5
Molecular weight (Da) 392.1

Drug properties

Molecular type Small molecule
Physiological/Surrogate Surrogate
Approved drug No

Database connections

Bioactivities

Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
GPR139 GP139 Human A orphans A pKi 6.92 6.92 6.92 Guide to Pharmacology
GPR139 GP139 Human A orphans A pKi 6.92 6.92 6.92 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
GPR139 GP139 Human A orphans A pEC50 7.66 7.66 7.66 Guide to Pharmacology
GPR139 GP139 Human A orphans A pEC50 7.66 7.66 7.66 ChEMBL