Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.40 |
| ▸ | HPGD | P15428 | 3/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 4/20 | 0.33 |
| ▸ | NPC1 | O15118 | 3/20 | 0.33 |
| ▸ | PKM | P14618 | 2/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | CES2 | O00748 | 1/20 | 0.33 |
| ▸ | CES1 | P23141 | 1/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.32 |
| ▸ | GAA | P10253 | 1/20 | 0.32 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.32 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.32 |
| ▸ | RELA | Q04206 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL3622990 | 0.78 | HTT (0.50) | SMN1; SMN2HPGDALDH1A1CYP1A2CYP3A4 | |
| SCHEMBL9799744 | 0.77 | ALDH1A1 (0.38) | SMN1; SMN2HPGDALDH1A1CYP1A2CYP3A4 | |
| SCHEMBL1428489 | 0.74 | MGLL (0.35) | SMN1; SMN2HPGDCYP2C9CYP2C19RAB9A | |
| SCHEMBL9799674 | 0.72 | ALDH1A1 (0.39) | SMN1; SMN2HPGDALDH1A1CYP1A2CYP3A4 | |
| SCHEMBL9799601 | 0.71 | CES2 (0.43) | HPGDALDH1A1CYP1A2CYP2C19HTT | |
| SCHEMBL9799595 | 0.71 | CES2 (0.43) | HPGDALDH1A1CYP1A2CYP2C19HTT | |
| SCHEMBL12779707 | 0.62 | MAPT (0.42) | CYP1A2CYP3A4CYP2D6CYP2C9CYP2C19 | |
| SCHEMBL11383129 | 0.61 | HPGD (0.44) | SMN1; SMN2HPGDALDH1A1CYP1A2CYP3A4 | |
| SCHEMBL7627838 | 0.61 | ALDH1A1 (0.58) | SMN1; SMN2HPGDALDH1A1CYP1A2CYP3A4 | |
| SCHEMBL3632187 | 0.61 | SMN1; SMN2 (0.58) | SMN1; SMN2HPGDALDH1A1CYP1A2CYP3A4 |
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 |
|---|---|---|---|---|---|---|---|
| US-5032169-A | Antidotes for herbicides | CIBA-GEIGY CORPORATION (US) | 1991-07-16 | — | — | US | claimed |