Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.57 |
| ▸ | RORC | P51449 | 2/20 | 0.51 |
| ▸ | BCHE | P06276 | 4/20 | 0.50 |
| ▸ | CNR2 | P34972 | 1/20 | 0.50 |
| ▸ | TSHR | P16473 | 4/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.48 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.47 |
| ▸ | DRD2 | P14416 | 1/20 | 0.46 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.46 |
| ▸ | DRD3 | P35462 | 1/20 | 0.46 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.46 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.46 |
| ▸ | AOC3 | Q16853 | 1/20 | 0.45 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL330083 | 0.91 | HRH3 (0.68) | HRH3RORCBCHECNR2TSHR | |
| SCHEMBL8240347 | 0.91 | HRH3 (0.61) | HRH3RORCBCHECNR2TSHR | |
| Water SCHEMBL28117059 | 0.89 | HRH3 (0.65) | HRH3RORCBCHECNR2TSHR | |
| Hydrochloric Acid SCHEMBL17710415 | 0.89 | HRH3 (0.65) | HRH3RORCBCHECNR2TSHR | |
| Hydrochloric Acid SCHEMBL3183297 | 0.89 | HRH3 (0.59) | HRH3RORCBCHECNR2TSHR | |
| SCHEMBL9286253 | 0.87 | HRH3 (0.57) | HRH3RORCBCHECNR2TSHR | |
| Hydrochloric Acid SCHEMBL11571118 | 0.85 | HRH3 (0.55) | HRH3RORCBCHECNR2TSHR | |
| SCHEMBL9485158 | 0.83 | MAPT (0.61) | HRH3RORCBCHETSHRHSD17B10 | |
| SCHEMBL11197923 | 0.83 | HRH3 (0.59) | HRH3RORCBCHECNR2TSHR | |
| SCHEMBL3372139 | 0.83 | HRH3 (0.53) | HRH3RORCBCHECNR2TSHR |
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 |
|---|---|---|---|---|---|---|---|
| EP-2922830-B1 | SYNTHESIS OF IMIDAZO(1,2-A)PYRAZIN-4-IUM SALTS FOR THE SYNTHESIS OF 1,4,7-TRIAZACYCLONONANE (TACN) AND N- AND/OR C-FUNCTIONALIZED DERIVATIVES THEREOF | UNIV BOURGOGNE (FR) | 2018-05-16 | — | — | EP | disclosed |