Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 4/20 | 0.64 |
| ▸ | RAB9A | P51151 | 4/20 | 0.64 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.59 |
| ▸ | HPGD | P15428 | 1/20 | 0.59 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.59 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.59 |
| ▸ | TOP2A | P11388 | 1/20 | 0.58 |
| ▸ | ALOX5 | P09917 | 2/20 | 0.58 |
| ▸ | GAA | P10253 | 1/20 | 0.57 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.57 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.56 |
| ▸ | MAPT | P10636 | 1/20 | 0.56 |
| ▸ | ESRRG | P62508 | 1/20 | 0.55 |
| ▸ | MEN1 | O00255 | 1/20 | 0.53 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.53 |
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 | |
|---|---|---|---|---|
| SCHEMBL5726019 | 0.86 | ALDH1A1 (0.63) | NPC1RAB9AALDH1A1HPGDALOX12 | |
| SCHEMBL6270935 | 0.86 | ALDH1A1 (0.77) | NPC1RAB9AALDH1A1HPGDALOX12 | |
| SCHEMBL29356619 | 0.86 | ALDH1A1 (0.77) | NPC1RAB9AALDH1A1HPGDALOX12 | |
| SCHEMBL12697047 | 0.86 | SMN1; SMN2 (0.64) | NPC1RAB9AHPGDSMN1; SMN2ALOX5 | |
| SCHEMBL9972948 | 0.81 | RAB9A (0.61) | NPC1RAB9ASMN1; SMN2GAAMAPT | |
| SCHEMBL7274134 | 0.81 | NPC1 (0.85) | NPC1RAB9AALDH1A1HPGDALOX12 | |
| SCHEMBL11716101 | 0.80 | MTNR1B (0.68) | NPC1RAB9AALDH1A1HPGDALOX12 | |
| SCHEMBL11717434 | 0.80 | NPC1 (0.66) | NPC1RAB9AALDH1A1HPGDALOX12 | |
| SCHEMBL14252956 | 0.79 | SMN1; SMN2 (0.77) | NPC1RAB9AALDH1A1HPGDALOX12 | |
| SCHEMBL27916802 | 0.78 | SMN1; SMN2 (0.58) | ALDH1A1HPGDSMN1; SMN2GAAMAPT |
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-1633715-A1 | 2-(6-AMINO-PYRIDIN-3-YL)-2-HYDROXYETHYLAMINE DERIVATIVES AS BETA 2-ADRENOCEPTORS AGONISTS | Pfizer Limited (GB) | 2006-03-15 | — | — | EP | disclosed |
| WO-2004108676-A1 | 2-(6-AMINO-PYRIDIN-3-YL)-2-HYDROXYETHYLAMINE DERIVATIVES AS BETA 2-ADRENOCEPTORS AGONISTS | PFIZER LIMITED (GB) | 2004-12-16 | — | — | WO | disclosed |