Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAAR1 | Q96RJ0 | 6/20 | 0.61 |
| ▸ | HTR2A | P28223 | 2/20 | 0.49 |
| ▸ | HTR1D | P28221 | 1/20 | 0.49 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.46 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.46 |
| ▸ | MEN1 | O00255 | 2/20 | 0.40 |
| ▸ | RAD52 | P43351 | 2/20 | 0.40 |
| ▸ | RECQL | P46063 | 2/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.40 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.40 |
| ▸ | GAPDH | P04406 | 1/20 | 0.40 |
| ▸ | THRB | P10828 | 1/20 | 0.40 |
| ▸ | APEX1 | P27695 | 1/20 | 0.40 |
| ▸ | BLM | P54132 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.39 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL18590775 | 0.89 | TAAR1 (0.45) | TAAR1HTR2AHTR1DCYP1A2CYP2A6 | |
| SCHEMBL18851313 | 0.88 | TAAR1 (0.47) | TAAR1HTR2AHTR1DCYP1A2CYP2A6 | |
| SCHEMBL3161137 | 0.84 | TAAR1 (0.47) | TAAR1HTR2AHTR1DCYP1A2CYP2A6 | |
| SCHEMBL14431599 | 0.83 | TAAR1 (0.67) | TAAR1HTR2AHTR1DCYP1A2CYP2A6 | |
| SCHEMBL9921236 | 0.83 | TAAR1 (0.41) | TAAR1HTR2AHTR1DCYP1A2CYP2A6 | |
| SCHEMBL24940563 | 0.81 | TAAR1 (0.44) | TAAR1MEN1KMT2ATDP1KDM4E | |
| SCHEMBL22248863 | 0.81 | TAAR1 (0.39) | TAAR1HTR2AHTR1DCYP1A2CYP2A6 | |
| SCHEMBL27465879 | 0.81 | DAO (0.47) | TAAR1HTR2AKDM4E | |
| SCHEMBL20244406 | 0.81 | CA2 (0.41) | TAAR1KDM4EMAPK1FFAR1FFAR4 | |
| SCHEMBL855681 | 0.80 | TAAR1 (0.69) | TAAR1HTR2AHTR1DCYP1A2CYP2A6 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3221298-A1 | 4-OXO-3,4-DIHYDRO-1,2,3-BENZOTRIAZINES AS MODULATORS OF GPR139 | Takeda Pharmaceutical Company Limited (JP) | 2017-09-27 | — | — | EP | disclosed |
| WO-2016081736-A1 | 4-OXO-3,4-DIHYDRO-1,2,3-BENZOTRIAZINES AS MODULATORS OF GPR139 | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2016-05-26 | — | — | WO | disclosed |