Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRPA1 | O75762 | 1/20 | 0.46 |
| ▸ | TAAR1 | Q96RJ0 | 5/20 | 0.41 |
| ▸ | IDO1 | P14902 | 2/20 | 0.39 |
| ▸ | AGXT | P21549 | 2/20 | 0.39 |
| ▸ | MAOA | P21397 | 2/20 | 0.39 |
| ▸ | MAOB | P27338 | 2/20 | 0.39 |
| ▸ | LOXL2 | Q9Y4K0 | 1/20 | 0.39 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.37 |
| ▸ | SLC18A2 | Q05940 | 1/20 | 0.37 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.37 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL4091905 | 0.81 | TAAR1 (0.59) | TAAR1MAOASLC6A2SLC18A2SIGMAR1 | |
| SCHEMBL4744203 | 0.80 | TAAR1 (0.47) | TAAR1IDO1AGXTCYP2D6 | |
| SCHEMBL178552 | 0.76 | TAAR1 (0.63) | TRPA1TAAR1SLC6A2SLC18A2SIGMAR1 | |
| SCHEMBL8976958 | 0.76 | TAAR1 (0.63) | TRPA1TAAR1SLC6A2SLC18A2SIGMAR1 | |
| SCHEMBL712488 | 0.76 | TAAR1 (0.61) | TRPA1TAAR1MAOALOXL2SLC6A2 | |
| SCHEMBL712487 | 0.76 | TAAR1 (0.61) | TRPA1TAAR1MAOALOXL2SLC6A2 | |
| SCHEMBL3238226 | 0.76 | TAAR1 (0.61) | TRPA1TAAR1MAOALOXL2SLC6A2 | |
| Hydrochloric Acid SCHEMBL23524437 | 0.75 | TAAR1 (0.61) | TRPA1TAAR1SLC6A2SLC18A2SIGMAR1 | |
| Hydrochloric Acid SCHEMBL15940967 | 0.74 | TAAR1 (0.59) | TRPA1TAAR1MAOALOXL2SLC6A2 | |
| Hydrochloric Acid SCHEMBL16321095 | 0.74 | TAAR1 (0.59) | TRPA1TAAR1MAOALOXL2SLC6A2 |
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-2008109613-A1 | BENZO[C][2,7]NAPHTHYRIDINE DERIVATIVES, AND THEIR USE AS KINASE INHIBITORS | WYETH (US) | 2008-09-12 | — | — | WO | disclosed |