Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 9/20 | 0.52 |
| ▸ | TTR | P02766 | 1/20 | 0.46 |
| ▸ | MAPT | P10636 | 3/20 | 0.46 |
| ▸ | HPGD | P15428 | 3/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.46 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.46 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.46 |
| ▸ | FDPS | P14324 | 1/20 | 0.45 |
| ▸ | LMNA | P02545 | 2/20 | 0.44 |
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
| ▸ | TACR2 | P21452 | 1/20 | 0.42 |
| ▸ | ALDH1A3 | P47895 | 2/20 | 0.41 |
| ▸ | ALDH3A1 | P30838 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.40 |
| ▸ | RELA | Q04206 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL944430 | 0.83 | ALDH1A1 (0.48) | ALDH1A1TTRMAPTHPGDCYP1A2 | |
| SCHEMBL566725 | 0.82 | ALDH1A1 (0.60) | ALDH1A1TTRMAPTHPGDCYP1A2 | |
| SCHEMBL30902399 | 0.82 | ALDH1A1 (0.60) | ALDH1A1TTRMAPTHPGDCYP1A2 | |
| SCHEMBL29956255 | 0.81 | ALDH1A1 (0.47) | ALDH1A1TTRMAPTHPGDCYP1A2 | |
| SCHEMBL566342 | 0.79 | CSNK2A1 (0.55) | ALDH1A1MAPTHPGDCYP1A2CYP2D6 | |
| Benzene SCHEMBL27642249 | 0.79 | TACR2 (0.57) | ALDH1A1MAPTHPGDCYP1A2CYP2D6 | |
| SCHEMBL31474820 | 0.79 | ALDH1A1 (0.50) | ALDH1A1TTRMAPTHPGDCYP1A2 | |
| SCHEMBL31471675 | 0.79 | ALDH1A1 (0.50) | ALDH1A1TTRMAPTHPGDCYP1A2 | |
| SCHEMBL2560176 | 0.79 | ALDH1A1 (0.44) | ALDH1A1TTRMAPTHPGDCYP1A2 | |
| SCHEMBL22322051 | 0.79 | FDPS (0.49) | ALDH1A1MAPTHPGDFDPSLMNA |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3921320-A1 | IMIDAZO [2, 1-F] [1, 2, 4] TRIAZIN-4-AMINE DERIVATIVES AS TLR7 AGONIST | BeiGene, Ltd. (KY) | 2021-12-15 | — | — | EP | disclosed |
| CN-113454086-A | Imidazo [2,1-F ] [1,2,4] triazin-4-amine derivatives as TLR7 agonists | 百济神州有限公司 | 2021-09-28 | — | — | CN | disclosed |
| WO-2020160711-A1 | IMIDAZO [2, 1-F] [1, 2, 4] TRIAZIN-4-AMINE DERIVATIVES AS TLR7 AGONIST | BEIGENE, LTD. (KY) | 2020-08-13 | — | — | WO | disclosed |