Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | P2RX1 | P51575 | 15/20 | 0.60 |
| ▸ | P2RX7 | Q99572 | 4/20 | 0.57 |
| ▸ | P2RX4 | Q99571 | 3/20 | 0.57 |
| ▸ | TMPRSS4 | Q9NRS4 | 3/20 | 0.53 |
| ▸ | P2RX3 | P56373 | 1/20 | 0.51 |
| ▸ | MAPT | P10636 | 1/20 | 0.50 |
| ▸ | THRB | P10828 | 1/20 | 0.50 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.48 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.46 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.46 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.46 |
| ▸ | RELA | Q04206 | 1/20 | 0.46 |
| ▸ | TACR1 | P25103 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL8720167 | 0.81 | BCAT2 (0.57) | — | |
| SCHEMBL8577008 | 0.78 | P2RX1 (0.49) | P2RX1P2RX7P2RX4TMPRSS4P2RX3 | |
| SCHEMBL8580261 | 0.77 | NPC1 (0.50) | MAPTPTGS1NFKB1NFKB2RELA | |
| SCHEMBL8576416 | 0.76 | P2RX1 (0.42) | P2RX1P2RX7P2RX4TMPRSS4P2RX3 | |
| SCHEMBL5666099 | 0.75 | P2RX1 (1.00) | P2RX1P2RX7P2RX4TMPRSS4P2RX3 | |
| Hydrochloric Acid SCHEMBL8717918 | 0.74 | HTT (0.52) | RXFP1 | |
| SCHEMBL10797383 | 0.74 | P2RX1 (0.73) | P2RX1P2RX7P2RX4TMPRSS4P2RX3 | |
| SCHEMBL127962 | 0.74 | P2RX1 (1.00) | P2RX1P2RX7P2RX4TMPRSS4P2RX3 | |
| SCHEMBL9081796 | 0.74 | GAA (0.45) | — | |
| SCHEMBL28258728 | 0.73 | P2RX1 (1.00) | P2RX1P2RX7P2RX4TMPRSS4P2RX3 |
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-1998017636-A1 | PHENYLALANINOL DERIVATIVES FOR THE TREATMENT OF CENTRAL NERVOUS SYSTEM DISORDERS | ORTHO PHARMACEUTICAL CORPORATION (US) | 1998-04-30 | — | — | WO | disclosed |