Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 2/20 | 0.51 |
| ▸ | P2RY1 | P47900 | 5/20 | 0.48 |
| ▸ | SLC5A1 | P13866 | 1/20 | 0.43 |
| ▸ | SLC5A2 | P31639 | 1/20 | 0.43 |
| ▸ | BRD4 | O60885 | 1/20 | 0.42 |
| ▸ | HTR1A | P08908 | 1/20 | 0.42 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.42 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.42 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.42 |
| ▸ | NPC1 | O15118 | 1/20 | 0.42 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.41 |
| ▸ | MRGPRX1 | Q96LB2 | 1/20 | 0.41 |
| ▸ | CACNA1C | Q13936 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL8341105 | 0.86 | P2RY1 (0.50) | P2RY1HTR1ASLC6A2SLC6A4SLC6A3 | |
| Hydrochloric Acid SCHEMBL8725899 | 0.82 | P2RY1 (0.48) | P2RY1HTR1ASLC6A2SLC6A4SLC6A3 | |
| SCHEMBL18137682 | 0.80 | BRD4 (0.56) | MAPTSLC5A1SLC5A2BRD4ALDH1A1 | |
| SCHEMBL14988166 | 0.74 | MAPK1 (0.45) | MAPTP2RY1ALDH1A1NPSR1MRGPRX1 | |
| SCHEMBL25227115 | 0.73 | MAPT (0.51) | MAPTSLC5A1SLC5A2BRD4ALDH1A1 | |
| SCHEMBL28244005 | 0.73 | BRD4 (0.55) | MAPTP2RY1BRD4ALDH1A1NPSR1 | |
| SCHEMBL8723588 | 0.73 | NPSR1 (0.46) | P2RY1HTR1ASLC6A2SLC6A4SLC6A3 | |
| SCHEMBL11732040 | 0.73 | MAPT (0.49) | MAPTBRD4ALDH1A1NPSR1NPC1 | |
| SCHEMBL9852615 | 0.72 | TRPM8 (0.59) | MAPTP2RY1 | |
| SCHEMBL19924873 | 0.72 | MAPT (0.56) | MAPTBRD4ALDH1A1NPSR1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0700391-B1 | HERBICIDAL COMPOUNDS | SHELL INT RESEARCH (NL) | 1998-10-21 | — | — | EP | disclosed |
| US-5759956-A | PYRAZINE CARBOXAMIDE DERIVATIVES | AMERICAN CYANAMID COMPANY (US) | 1998-06-02 | — | — | US | disclosed |
| EP-0700391-A1 | HERBICIDAL COMPOUNDS | SHELL INTERNATIONALE RESEARCHMAATSCHAPPIJ B.V. (NL) | 1996-03-13 | — | — | EP | disclosed |
| WO-1994027974-A1 | HERBICIDAL COMPOUNDS | SHELL INTERNATIONALE RESEARCH MAATSCHAPPIJ B.V. (NL) | 1994-12-08 | — | — | WO | disclosed |