Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.45 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.45 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.45 |
| ▸ | FFAR1 | O14842 | 2/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | IGF1R | P08069 | 1/20 | 0.40 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.40 |
| ▸ | DAO | P14920 | 1/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | SLC5A1 | P13866 | 1/20 | 0.39 |
| ▸ | SLC5A2 | P31639 | 1/20 | 0.39 |
| ▸ | IDO1 | P14902 | 3/20 | 0.38 |
| ▸ | CHKA | P35790 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | GPR84 | Q9NQS5 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL19974048 | 0.98 | CYP1A2 (0.46) | CYP1A2CYP2A6TAAR1FFAR1TDP1 | |
| SCHEMBL20513970 | 0.78 | KEAP1 (0.46) | CYP2A6TAAR1FFAR1TDP1ALOX15 | |
| SCHEMBL28203515 | 0.77 | ABAT (0.44) | TAAR1L3MBTL1ALDH1A1HRH3 | |
| SCHEMBL2637417 | 0.77 | GFER (0.54) | TAAR1TDP1L3MBTL1NPC1RAB9A | |
| SCHEMBL16454778 | 0.76 | IDO1 (0.42) | CYP1A2CYP2A6TAAR1TDP1L3MBTL1 | |
| SCHEMBL942065 | 0.76 | KEAP1 (0.48) | CYP2A6TAAR1FFAR1TDP1ALOX15 | |
| SCHEMBL7928397 | 0.76 | KEAP1 (0.48) | CYP2A6TAAR1FFAR1TDP1ALOX15 | |
| SCHEMBL23881658 | 0.75 | TAAR1 (0.53) | TAAR1DAOIDO1GPR84HRH3 | |
| SCHEMBL14381097 | 0.75 | ALDH1A1 (0.58) | ALDH1A1MEN1KMT2A | |
| SCHEMBL28636907 | 0.75 | ALDH1A1 (0.58) | ALDH1A1MEN1KMT2A |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3380551-A1 | POLYMERIC FLAME RETARDANT MIXTURES | Clariant Plastics & Coatings Ltd (CH) | 2018-10-03 | — | — | EP | disclosed |