Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRPA1 | O75762 | 10/20 | 0.34 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.31 |
| ▸ | NPC1 | O15118 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
| ▸ | XBP1 | P17861 | 1/20 | 0.31 |
| ▸ | HTT | P42858 | 1/20 | 0.31 |
| ▸ | RAB9A | P51151 | 1/20 | 0.31 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.31 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.31 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.31 |
| ▸ | POLB | P06746 | 1/20 | 0.31 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.31 |
| ▸ | CNR1 | P21554 | 1/20 | 0.31 |
| ▸ | ACHE | P22303 | 1/20 | 0.31 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.31 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.31 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.31 |
| ▸ | NTSR1 | P30989 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL25165834 | 0.77 | TRPA1 (0.42) | TRPA1ALDH1A1SMN1; SMN2NPC1RAB9A | |
| SCHEMBL21363445 | 0.77 | TRPA1 (0.33) | TRPA1ALDH1A1SMN1; SMN2KMT2AHPGD | |
| SCHEMBL24375561 | 0.69 | CYP1A2 (0.31) | ALDH1A1SMN1; SMN2POLBKDM4EGLA | |
| SCHEMBL17163966 | 0.65 | HTT (0.36) | ALDH1A1HTT | |
| SCHEMBL8404472 | 0.64 | — | — | |
| SCHEMBL20203175 | 0.64 | TRPA1 (0.41) | TRPA1PIK3CDPOLBADORA3CNR1 | |
| SCHEMBL15382212 | 0.64 | ALDH1A1 (0.33) | ALDH1A1ADORA2AADORA2BF2KMT2A | |
| SCHEMBL21895459 | 0.63 | ADORA2A (0.35) | ALDH1A1NPC1MAPTHTTRAB9A | |
| SCHEMBL23679319 | 0.63 | BRD9 (0.32) | NFE2L2ALDH1A1MAPTRXFP1F2 | |
| SCHEMBL21363426 | 0.62 | TRPA1 (0.36) | TRPA1 |
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-2019182925-A1 | OXADIAZOLE TRANSIENT RECEPTOR POTENTIAL CHANNEL INHIBITORS | GENENTECH, INC. (US) | 2019-09-26 | — | — | WO | disclosed |