Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MTNR1A | P48039 | 3/20 | 0.63 |
| ▸ | MTNR1B | P49286 | 3/20 | 0.63 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.63 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.63 |
| ▸ | HPGD | P15428 | 2/20 | 0.63 |
| ▸ | TSHR | P16473 | 2/20 | 0.63 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.63 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.63 |
| ▸ | MEN1 | O00255 | 2/20 | 0.63 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.63 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.63 |
| ▸ | EGFR | P00533 | 3/20 | 0.63 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.62 |
| ▸ | MAPT | P10636 | 2/20 | 0.62 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.62 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.62 |
| ▸ | MC4R | P32245 | 4/20 | 0.57 |
| ▸ | MC5R | P33032 | 4/20 | 0.57 |
| ▸ | MC3R | P41968 | 4/20 | 0.57 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.52 |
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 | |
|---|---|---|---|---|
| SCHEMBL2944735 | 0.92 | MTNR1A (0.66) | MTNR1AMTNR1BCYP1A2CYP3A4HPGD | |
| SCHEMBL2087168 | 0.82 | HPGD (0.61) | MTNR1AMTNR1BCYP1A2CYP3A4HPGD | |
| SCHEMBL9368557 | 0.81 | FFAR1 (0.47) | MTNR1AMTNR1BCYP1A2CYP3A4HPGD | |
| SCHEMBL30547373 | 0.80 | EGFR (0.62) | MTNR1AMTNR1BCYP1A2CYP3A4HPGD | |
| SCHEMBL9153503 | 0.80 | KDM4E (0.69) | CYP3A4TSHRTDP1EGFRALDH1A1 | |
| SCHEMBL31034424 | 0.78 | HPGD (0.58) | MTNR1AMTNR1BCYP1A2CYP3A4HPGD | |
| SCHEMBL25276059 | 0.78 | EGFR (0.68) | MEN1KMT2AEGFRALDH1A1MAPT | |
| SCHEMBL28472093 | 0.78 | OXER1 (0.61) | HPGDMEN1KMT2AEGFRALDH1A1 | |
| SCHEMBL28190374 | 0.78 | EGFR (0.68) | MEN1KMT2AEGFRALDH1A1MAPT | |
| SCHEMBL3276610 | 0.78 | KDM4E (0.83) | EGFRALDH1A1KDM4EGPR17 |
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-2000029022-A1 | COX-2 INHIBITORS IN COMBINATION WITH CENTRALLY ACTING ANALGESICS | ALGOS PHARMACEUTICAL CORPORATION (US) | 2000-05-25 | — | — | WO | claimed |