Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HPGD | P15428 | 2/20 | 0.62 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.53 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.52 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.52 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.52 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.52 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.50 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.50 |
| ▸ | SYK | P43405 | 1/20 | 0.48 |
| ▸ | MEN1 | O00255 | 3/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.48 |
| ▸ | GAA | P10253 | 1/20 | 0.48 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.48 |
| ▸ | LMNA | P02545 | 2/20 | 0.48 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.48 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.47 |
| ▸ | DRD4 | P21917 | 2/20 | 0.47 |
| ▸ | NPC1 | O15118 | 1/20 | 0.46 |
| ▸ | RAB9A | P51151 | 1/20 | 0.46 |
| ▸ | MAPT | P10636 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL16002927 | 0.86 | HPGD (0.69) | HPGDALDH1A1CYP2D6CYP2C9CYP1A2 | |
| SCHEMBL16000504 | 0.84 | HPGD (0.66) | HPGDALDH1A1CYP2D6CYP2C9CYP1A2 | |
| SCHEMBL14970147 | 0.79 | HPGD (0.81) | HPGDALDH1A1CYP2D6CYP2C9CYP1A2 | |
| SCHEMBL12963767 | 0.78 | HPGD (0.79) | HPGDALDH1A1KDM4EMEN1KMT2A | |
| SCHEMBL16002912 | 0.77 | HPGD (0.56) | HPGDALDH1A1CYP2D6CYP2C9CYP1A2 | |
| SCHEMBL10049918 | 0.76 | HPGD (0.75) | HPGDALDH1A1KDM4EMEN1KMT2A | |
| SCHEMBL13826409 | 0.75 | HPGD (0.54) | HPGDALDH1A1CYP2D6CYP2C9CYP1A2 | |
| SCHEMBL22242615 | 0.74 | HPGD (0.61) | HPGDALDH1A1CYP2D6CYP2C9CYP1A2 | |
| SCHEMBL22242682 | 0.74 | HPGD (0.67) | HPGDALDH1A1CYP2D6CYP2C9CYP1A2 | |
| Hydrochloric Acid SCHEMBL6276059 | 0.72 | EPHX1 (0.61) | ALDH1A1KDM4EMEN1KMT2ADRD4 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2012154518-A1 | BIPYRIDYLAMINOPYRIDINES AS SYK INHIBITORS | MERCK SHARP & DOHME CORP. (US) | 2012-11-15 | — | — | WO | disclosed |