Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SPR | P35270 | 1/20 | 0.64 |
| ▸ | HPGD | P15428 | 2/20 | 0.59 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.59 |
| ▸ | HTR6 | P50406 | 6/20 | 0.49 |
| ▸ | HTR1A | P08908 | 3/20 | 0.46 |
| ▸ | HTR1D | P28221 | 2/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.46 |
| ▸ | NQO2 | P16083 | 1/20 | 0.46 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.46 |
| ▸ | MTNR1B | P49286 | 1/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.45 |
| ▸ | LMNA | P02545 | 1/20 | 0.45 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.45 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.45 |
| ▸ | MPO | P05164 | 1/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.45 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.45 |
| ▸ | MAPT | P10636 | 1/20 | 0.45 |
| ▸ | CYP2C9 | P11712 | 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 | |
|---|---|---|---|---|
| SCHEMBL4350200 | 0.89 | HPGD (0.57) | SPRHPGDCYP2C19HTR6CYP1A2 | |
| SCHEMBL14487470 | 0.87 | SPR (0.60) | SPRHPGDCYP2C19HTR6HTR1A | |
| SCHEMBL9371511 | 0.84 | SPR (0.62) | SPRHPGDCYP2C19HTR6HTR1A | |
| SCHEMBL2538876 | 0.83 | SPR (0.61) | SPRHPGDCYP2C19HTR6HTR1A | |
| SCHEMBL14555323 | 0.83 | SPR (0.60) | SPRHPGDCYP2C19HTR6HTR1A | |
| SCHEMBL12352688 | 0.82 | SPR (0.67) | SPRHPGDCYP2C19HTR6HTR1A | |
| SCHEMBL21247057 | 0.82 | HPGD (0.61) | SPRHPGDCYP2C19HTR1AHTR1D | |
| SCHEMBL8544819 | 0.82 | HTR6 (0.59) | HPGDCYP2C19HTR6MAPT | |
| SCHEMBL4159606 | 0.81 | SPR (0.46) | SPRHPGDCYP2C19HTR6HTR1A | |
| SCHEMBL14487812 | 0.80 | SPR (0.64) | SPRHPGDHTR6HTR1AHTR1D |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0464558-B1 | Antimigraine alkoxypyrimidine derivatives | BRISTOL MYERS SQUIBB CO (US) | 1994-12-28 | — | — | EP | disclosed |
| EP-0464558-A1 | Antimigraine alkoxypyrimidine derivatives | Bristol-Myers Squibb Company (US) | 1992-01-08 | — | — | EP | disclosed |