Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.53 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.53 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.53 |
| ▸ | HPGD | P15428 | 1/20 | 0.53 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.53 |
| ▸ | HTT | P42858 | 1/20 | 0.53 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.52 |
| ▸ | NR4A2 | P43354 | 1/20 | 0.47 |
| ▸ | MEN1 | O00255 | 1/20 | 0.46 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.45 |
| ▸ | IMPDH2 | P12268 | 3/20 | 0.43 |
| ▸ | TUBB4A | P04350 | 1/20 | 0.43 |
| ▸ | TUBB | P07437 | 1/20 | 0.43 |
| ▸ | TUBA3C | P0DPH7 | 1/20 | 0.43 |
| ▸ | TUBA1B | P68363 | 1/20 | 0.43 |
| ▸ | TUBA4A | P68366 | 1/20 | 0.43 |
| ▸ | TUBB4B | P68371 | 1/20 | 0.43 |
| ▸ | TUBB3 | Q13509 | 1/20 | 0.43 |
| ▸ | TUBB2A | Q13885 | 1/20 | 0.43 |
| ▸ | TUBB8 | Q3ZCM7 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL5080187 | 0.89 | PDE4B (0.54) | ALDH1A1CYP2C19CYP1A2HPGDHSD17B10 | |
| SCHEMBL10604070 | 0.85 | THRA (0.50) | ALDH1A1CYP2C19HPGDHSD17B10KMT2A | |
| SCHEMBL15445316 | 0.84 | TUBB4A (0.46) | ALDH1A1CYP2C19CYP1A2HPGDHSD17B10 | |
| SCHEMBL6822746 | 0.84 | MAPK1 (0.56) | ALDH1A1CYP2C19CYP1A2HPGDHSD17B10 | |
| SCHEMBL29317427 | 0.82 | KMT2A (0.57) | ALDH1A1CYP2C19CYP1A2HPGDHSD17B10 | |
| SCHEMBL9720532 | 0.81 | ALDH1A1 (0.61) | ALDH1A1CYP2C19KMT2AMEN1TUBB4A | |
| SCHEMBL10605850 | 0.81 | THRA (0.57) | ALDH1A1KMT2AMEN1THRATHRB | |
| SCHEMBL19287112 | 0.80 | THRA (0.41) | ALDH1A1CYP2C19CYP1A2HPGDHSD17B10 | |
| SCHEMBL5495178 | 0.80 | CTNNB1 (0.60) | ALDH1A1CYP2C19CYP1A2HPGDHSD17B10 | |
| SCHEMBL4085923 | 0.79 | KMT2A (0.53) | ALDH1A1CYP2C19CYP1A2HPGDHSD17B10 |
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-0176294-B1 | CYCLOHEXANE-1,3-DIONE DERIVATIVES, COMPOSITIONS CONTAINING THEM, PROCESSES FOR PREPARING THEM, AND THEIR USE AS HERBICIDES AND PLANT GROWTH REGULATORS | ICI AUSTRALIA LIMITED (AU) | 1991-06-05 | — | — | EP | disclosed |
| US-4639267-A | Herbicidal cyclohexane-1,3-dione derivatives | ICI AUSTRALIA LIMITED (AU) | 1987-01-27 | — | — | US | disclosed |
| EP-0176294-A1 | Cyclohexane-1,3-dione derivatives, compositions containing them, processes for preparing them, and their use as herbicides and plant growth regulators | ICI AUSTRALIA LIMITED (AU) | 1986-04-02 | — | — | EP | disclosed |