Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GSK3B | P49841 | 2/20 | 0.44 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.44 |
| ▸ | RAB9A | P51151 | 3/20 | 0.43 |
| ▸ | NPC1 | O15118 | 1/20 | 0.43 |
| ▸ | HPGD | P15428 | 5/20 | 0.42 |
| ▸ | GAA | P10253 | 2/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.41 |
| ▸ | MEN1 | O00255 | 2/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 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 | |
|---|---|---|---|---|
| SCHEMBL14600764 | 0.88 | ADORA2A (0.40) | GSK3BKCNH2KMT2AMEN1 | |
| SCHEMBL10067975 | 0.85 | ALDH1A1 (0.46) | GSK3BKCNH2RAB9ANPC1HPGD | |
| SCHEMBL14600763 | 0.85 | GSK3B (0.44) | GSK3BKCNH2RAB9ANPC1HPGD | |
| SCHEMBL14600774 | 0.85 | GSK3B (0.45) | GSK3BKCNH2RAB9ANPC1HPGD | |
| SCHEMBL14278772 | 0.84 | MAPK1 (0.49) | GSK3BKCNH2RAB9ANPC1HPGD | |
| SCHEMBL10067977 | 0.83 | GSK3B (0.47) | GSK3BKCNH2RAB9ANPC1HPGD | |
| SCHEMBL14600777 | 0.77 | GSK3B (0.53) | GSK3BKCNH2RAB9ANPC1HPGD | |
| SCHEMBL14600753 | 0.76 | GSK3B (0.53) | GSK3BKCNH2RAB9ANPC1HPGD | |
| SCHEMBL5037119 | 0.76 | GSK3B (0.51) | GSK3BKCNH2RAB9ANPC1HPGD | |
| SCHEMBL5037115 | 0.76 | GSK3B (0.51) | GSK3BKCNH2RAB9ANPC1HPGD |
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-1697352-B1 | 4-AZOLE SUBSTITUTED IMIDAZOLE COMPOSITIONS USEFUL AS INHIBITORS OR C-MET RECEPTOR TYROSINE KINASE | VERTEX PHARMA (US) | 2012-06-27 | — | — | EP | disclosed |
| US-7169800-B2 | Imidazole compositions useful as inhibitors of protein kinases | VERTEX PHARMACEUTICALS INCORPORATED (US) | 2007-01-30 | — | — | US | disclosed |
| US-7169800-B2 | Imidazole compositions useful as inhibitors of protein kinases | VERTEX PHARMACEUTICALS INCORPORATED (US) | 2007-01-30 | — | — | US | disclosed |