Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGER4 | P35408 | 9/20 | 0.67 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.64 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.64 |
| ▸ | NSD2 | O96028 | 1/20 | 0.47 |
| ▸ | POLB | P06746 | 1/20 | 0.47 |
| ▸ | GRK2 | P25098 | 1/20 | 0.47 |
| ▸ | CASP6 | P55212 | 1/20 | 0.47 |
| ▸ | CTDSP1 | Q9GZU7 | 1/20 | 0.47 |
| ▸ | DUSP3 | P51452 | 1/20 | 0.47 |
| ▸ | DUSP22 | Q9NRW4 | 1/20 | 0.47 |
| ▸ | PPARA | Q07869 | 2/20 | 0.47 |
| ▸ | PPARD | Q03181 | 1/20 | 0.47 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.46 |
| ▸ | ABCC4 | O15439 | 1/20 | 0.45 |
| ▸ | LMNA | P02545 | 1/20 | 0.45 |
| ▸ | GAA | P10253 | 1/20 | 0.45 |
| ▸ | TSHR | P16473 | 1/20 | 0.45 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.45 |
| ▸ | HTT | P42858 | 1/20 | 0.45 |
| ▸ | CA2 | P00918 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL4409667 | 0.89 | PTGER4 (0.88) | PTGER4CYP1A2CYP2D6NSD2POLB | |
| SCHEMBL12289129 | 0.87 | PTGER4 (0.55) | PTGER4CYP1A2CYP2D6PPARAPPARD | |
| SCHEMBL4410607 | 0.87 | PTGER4 (0.89) | PTGER4CYP1A2CYP2D6 | |
| SCHEMBL3967404 | 0.86 | PTGER4 (0.68) | PTGER4CYP1A2CYP2D6NSD2POLB | |
| SCHEMBL4611030 | 0.85 | PTGER4 (0.74) | PTGER4CYP1A2CYP2D6 | |
| SCHEMBL13415490 | 0.84 | PTGER4 (0.70) | PTGER4CYP1A2CYP2D6NSD2POLB | |
| SCHEMBL5793779 | 0.82 | KMT2A (0.55) | PTGER4CYP1A2CYP2D6POLBCASP6 | |
| SCHEMBL12289134 | 0.81 | PTGER4 (0.50) | PTGER4CYP1A2CYP2D6PPARAPPARD | |
| SCHEMBL10058499 | 0.81 | PTGER4 (0.57) | PTGER4CYP1A2CYP2D6POLBGAA | |
| SCHEMBL3566476 | 0.81 | PTGER4 (1.00) | PTGER4CYP1A2CYP2D6NSD2POLB |
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-1979317-B1 | BENZOISOINDOLE DERIVATIVES FOR THE TREATMENT OF PAIN | GLAXO GROUP LTD (GB) | 2012-08-22 | — | — | EP | disclosed |
| WO-2009019281-A1 | BENZOISOINDOLE DERIVATIVES AND THEIR USE AS EP4 RECEPTOR AGONISTS FOR THE TREATMENT OF PAIN | GLAXO GROUP LIMITED (GB) | 2009-02-12 | — | — | WO | disclosed |