Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 3/20 | 0.57 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.57 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.50 |
| ▸ | CNR2 | P34972 | 2/20 | 0.47 |
| ▸ | CES2 | O00748 | 2/20 | 0.47 |
| ▸ | CES1 | P23141 | 2/20 | 0.47 |
| ▸ | DNM1 | Q05193 | 2/20 | 0.47 |
| ▸ | TP53 | P04637 | 1/20 | 0.46 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.46 |
| ▸ | HPGD | P15428 | 1/20 | 0.45 |
| ▸ | HTT | P42858 | 2/20 | 0.44 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.44 |
| ▸ | MMP2 | P08253 | 1/20 | 0.44 |
| ▸ | MMP9 | P14780 | 1/20 | 0.44 |
| ▸ | MMP8 | P22894 | 1/20 | 0.44 |
| ▸ | MMP13 | P45452 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL8671811 | 0.98 | MEN1 (0.60) | MEN1KMT2AEPHX2CNR2CES2 | |
| SCHEMBL14780162 | 0.96 | MEN1 (0.57) | MEN1KMT2AEPHX2CNR2CES2 | |
| SCHEMBL6548911 | 0.94 | MEN1 (0.60) | MEN1KMT2AEPHX2CNR2CES2 | |
| SCHEMBL6868772 | 0.94 | MEN1 (0.60) | MEN1KMT2AEPHX2CNR2CES2 | |
| SCHEMBL9478868 | 0.94 | MEN1 (0.60) | MEN1KMT2AEPHX2CNR2CES2 | |
| SCHEMBL9666181 | 0.94 | MEN1 (0.60) | MEN1KMT2AEPHX2CNR2CES2 | |
| SCHEMBL8673057 | 0.94 | MEN1 (0.50) | MEN1KMT2AEPHX2CNR2CES2 | |
| SCHEMBL17144941 | 0.92 | MEN1 (0.58) | MEN1KMT2AEPHX2CNR2CES2 | |
| SCHEMBL17144939 | 0.92 | MEN1 (0.58) | MEN1KMT2AEPHX2CNR2CES2 | |
| SCHEMBL16990755 | 0.90 | MEN1 (0.57) | MEN1KMT2AEPHX2CNR2CES2 |
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 |