Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.43 |
| ▸ | ACHE | P22303 | 2/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.43 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.43 |
| ▸ | IGF1R | P08069 | 1/20 | 0.43 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | KCNJ1 | P48048 | 1/20 | 0.40 |
| ▸ | PLAAT3 | P53816 | 1/20 | 0.40 |
| ▸ | PLAAT5 | Q96KN8 | 1/20 | 0.40 |
| ▸ | PLAAT2 | Q9NWW9 | 1/20 | 0.40 |
| ▸ | PLAAT4 | Q9UL19 | 1/20 | 0.40 |
| ▸ | HRH1 | P35367 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | FDFT1 | P37268 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL9356418 | 0.96 | IGF1R (0.47) | ALDH1A1ACHEHSD17B10CYP1A2CYP2A6 | |
| SCHEMBL2441925 | 0.88 | ACHE (0.46) | ALDH1A1ACHEHSD17B10CYP1A2CYP2A6 | |
| SCHEMBL1687902 | 0.84 | ALDH1A1 (0.46) | ALDH1A1TAAR1KMT2AMEN1KCNJ1 | |
| SCHEMBL2724731 | 0.81 | ALDH1A1 (0.61) | ALDH1A1ACHEHSD17B10CYP3A4 | |
| SCHEMBL901008 | 0.81 | ALDH1A1 (0.61) | ALDH1A1ACHEHSD17B10CYP3A4 | |
| SCHEMBL11551629 | 0.80 | KCNJ1 (0.50) | ALDH1A1TAAR1KMT2AMEN1KCNJ1 | |
| SCHEMBL11560785 | 0.80 | CYP1A2 (0.44) | ALDH1A1CYP1A2TAAR1IGF1RALOX15 | |
| SCHEMBL27541590 | 0.80 | TAAR1 (0.43) | ALDH1A1TAAR1KCNJ1PLAAT3PLAAT5 | |
| SCHEMBL27765863 | 0.80 | ESR1 (0.50) | ALDH1A1ACHEHSD17B10TAAR1IGF1R | |
| SCHEMBL7051536 | 0.79 | KCNJ1 (0.54) | ALDH1A1TAAR1IGF1RALOX15KCNJ1 |
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-2012041359-A1 | PROCESS FOR MAKING FINGOLIMOD | SYNTHON B.V. (NL) | 2012-04-05 | — | — | WO | disclosed |
| US-4163057-A | Isoxazole-4-carboxamides as tranquilizers, sleep-inducers and muscle relaxants | SANDOZ, INC. (US) | 1979-07-31 | — | — | US | disclosed |