Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 6/20 | 0.53 |
| ▸ | RAB9A | P51151 | 6/20 | 0.53 |
| ▸ | TAAR1 | Q96RJ0 | 3/20 | 0.53 |
| ▸ | GAA | P10253 | 2/20 | 0.53 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.50 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.50 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.50 |
| ▸ | LMNA | P02545 | 3/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.48 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.46 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.46 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.46 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.46 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.46 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.46 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.46 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.46 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.46 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL9566981 | 0.87 | CYP1A2 (0.67) | NPC1RAB9AGAACYP1A2CYP2D6 | |
| SCHEMBL15190289 | 0.80 | ALDH1A1 (0.68) | NPC1RAB9ATAAR1GAALMNA | |
| SCHEMBL9315116 | 0.79 | LMNA (0.76) | NPC1RAB9AGAACYP1A2CYP2D6 | |
| SCHEMBL580074 | 0.78 | OPRM1 (0.51) | NPC1RAB9AALDH1A1HPGD | |
| SCHEMBL15190342 | 0.77 | FAAH (0.55) | NPC1RAB9AALDH1A1SMN1; SMN2MAPT | |
| SCHEMBL15190381 | 0.77 | FAAH (0.55) | NPC1RAB9ATAAR1GAALMNA | |
| SCHEMBL15189997 | 0.76 | FAAH (0.54) | NPC1RAB9ATAAR1GAALMNA | |
| SCHEMBL15189995 | 0.75 | RAB9A (0.57) | NPC1RAB9AGAACYP1A2CYP2C19 | |
| SCHEMBL15190219 | 0.75 | ALDH1A1 (0.55) | NPC1RAB9AGAACYP1A2CYP2C19 | |
| SCHEMBL15190158 | 0.73 | ALDH1A1 (0.53) | NPC1RAB9AGAALMNAALDH1A1 |
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-0551821-A1 | Isoxazolecarboxylic acid derivatives and their use as herbicides | BAYER AG (DE) | 1993-07-21 | — | — | EP | claimed |
| EP-0551821-A1 | Isoxazolecarboxylic acid derivatives and their use as herbicides | BAYER AG (DE) | 1993-07-21 | — | — | EP | disclosed |