Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPK1 | P28482 | 2/20 | 0.51 |
| ▸ | NOS1 | P29475 | 4/20 | 0.46 |
| ▸ | MAPT | P10636 | 2/20 | 0.46 |
| ▸ | ROCK2 | O75116 | 2/20 | 0.46 |
| ▸ | METAP2 | P50579 | 1/20 | 0.46 |
| ▸ | CSNK2A1 | P68400 | 1/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.46 |
| ▸ | MEN1 | O00255 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.46 |
| ▸ | GAA | P10253 | 1/20 | 0.46 |
| ▸ | HPGD | P15428 | 1/20 | 0.46 |
| ▸ | RAB9A | P51151 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.46 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.46 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.46 |
| ▸ | MAOB | P27338 | 5/20 | 0.45 |
| ▸ | NEK2 | P51955 | 1/20 | 0.44 |
| ▸ | CLK1 | P49759 | 2/20 | 0.42 |
| ▸ | GSK3B | P49841 | 2/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL8669601 | 0.84 | NOS1 (0.46) | MAPK1NOS1MAPTMETAP2KDM4E | |
| SCHEMBL1605539 | 0.80 | MAPK1 (0.57) | MAPK1NOS1MAPTROCK2METAP2 | |
| SCHEMBL29569257 | 0.78 | NOS1 (0.53) | MAPK1NOS1MAPTROCK2METAP2 | |
| SCHEMBL182465 | 0.78 | NOS1 (0.53) | MAPK1NOS1MAPTROCK2METAP2 | |
| SCHEMBL8666610 | 0.77 | NOS1 (0.57) | MAPK1NOS1MAPTROCK2METAP2 | |
| SCHEMBL8713967 | 0.75 | FGFR1 (0.51) | NOS1MAPTMETAP2KDM4EMEN1 | |
| SCHEMBL15069783 | 0.74 | MAPK1 (0.55) | MAPK1NOS1MAPTROCK2METAP2 | |
| SCHEMBL764032 | 0.74 | CDC7 (0.55) | MAPK1NOS1MAPTROCK2METAP2 | |
| SCHEMBL12833351 | 0.74 | NOS1 (0.53) | MAPK1NOS1MAPTROCK2METAP2 | |
| SCHEMBL6599321 | 0.74 | ROCK2 (0.53) | MAPK1NOS1MAPTROCK2METAP2 |
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 |
|---|---|---|---|---|---|---|---|
| US-5811422-A | USEFUL FOR TREATING VIRAL INFECTIONS | THE DUPONT MERCK PHARMACEUTICAL COMPANY (US) | 1998-09-22 | — | — | US | disclosed |
| US-5610294-A | VIRAL TREATMENT | THE DU PONT MERCK PHARMACEUTICAL COMPANY (US) | 1997-03-11 | — | — | US | disclosed |
| EP-0686151-A1 | SUBSTITUTED CYCLIC CARBONYLS AND DERIVATIVES THEREOF USEFUL AS RETROVIRAL PROTEASE INHIBITORS | THE DU PONT MERCK PHARMACEUTICAL COMPANY (US) | 1995-12-13 | — | — | EP | disclosed |