Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | FFAR1 | O14842 | 1/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.45 |
| ▸ | UNG | P13051 | 1/20 | 0.41 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | CYP1A1 | P04798 | 2/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.38 |
| ▸ | CYP1B1 | Q16678 | 2/20 | 0.38 |
| ▸ | SRC | P12931 | 1/20 | 0.37 |
| ▸ | TRIM24 | O15164 | 2/20 | 0.36 |
| ▸ | TRIM33 | Q9UPN9 | 2/20 | 0.36 |
| ▸ | MAOA | P21397 | 3/20 | 0.36 |
| ▸ | MAOB | P27338 | 3/20 | 0.36 |
| ▸ | BRD4 | O60885 | 1/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.35 |
| ▸ | AOX1 | Q06278 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | ALDH5A1 | P51649 | 1/20 | 0.35 |
| ▸ | ABAT | P80404 | 1/20 | 0.35 |
| ▸ | CA12 | O43570 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL10633500 | 0.87 | FFAR1 (0.58) | FFAR1ALDH1A1UNGCYP2A6TSHR | |
| SCHEMBL29622470 | 0.82 | FFAR1 (0.62) | FFAR1ALDH1A1UNGCYP2A6TRIM24 | |
| SCHEMBL3735218 | 0.82 | FFAR1 (0.62) | FFAR1ALDH1A1UNGCYP2A6TRIM24 | |
| SCHEMBL17472590 | 0.80 | CYP1A1 (0.47) | FFAR1ALDH1A1CYP2A6TSHRCYP1A1 | |
| SCHEMBL2934101 | 0.79 | FFAR1 (0.46) | FFAR1ALDH1A1UNGCYP2A6TSHR | |
| SCHEMBL31044602 | 0.79 | FFAR1 (0.46) | FFAR1ALDH1A1UNGCYP2A6TSHR | |
| SCHEMBL2876029 | 0.78 | CYP1A1 (0.48) | CYP1A1CYP1A2CYP1B1HAO1 | |
| SCHEMBL7054246 | 0.77 | FFAR1 (0.54) | FFAR1ALDH1A1UNGSRCALDH5A1 | |
| SCHEMBL3109157 | 0.77 | ALDH1A1 (0.50) | FFAR1ALDH1A1UNGCYP2A6SRC | |
| SCHEMBL2278501 | 0.77 | FFAR1 (0.47) | FFAR1ALDH1A1UNGTSHRSRC |
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 |
|---|---|---|---|---|---|---|---|
| WO-2010136475-A1 | SUBSTITUTED QUINAZOLINES AS FUNGICIDES | SYNGENTA PARTICIPATIONS AG (CH) | 2010-12-02 | — | — | WO | disclosed |
| EP-0503079-A1 | PYRIDAZINONE-SUBSTITUTED ETHYNYLPHENYL DERIVATIVE AND REMEDY FOR CIRCULATORY ORGAN DISEASE CONTAINING THE SAME AS ACTIVE INGREDIENT | KAKEN PHARMACEUTICAL CO., LTD. (JP) | 1992-09-16 | — | — | EP | disclosed |