Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCR1 | P32246 | 2/20 | 0.58 |
| ▸ | TRPA1 | O75762 | 4/20 | 0.53 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.50 |
| ▸ | GAA | P10253 | 1/20 | 0.50 |
| ▸ | HTT | P42858 | 2/20 | 0.49 |
| ▸ | CA2 | P00918 | 1/20 | 0.48 |
| ▸ | POLB | P06746 | 2/20 | 0.48 |
| ▸ | S1PR4 | O95977 | 1/20 | 0.47 |
| ▸ | S1PR3 | Q99500 | 1/20 | 0.47 |
| ▸ | UTS2R | Q9UKP6 | 1/20 | 0.47 |
| ▸ | NPC1 | O15118 | 1/20 | 0.47 |
| ▸ | RAB9A | P51151 | 1/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.46 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.46 |
| ▸ | CES2 | O00748 | 1/20 | 0.46 |
| ▸ | CES1 | P23141 | 1/20 | 0.46 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL76893 | 0.87 | SMN1; SMN2 (0.54) | CA2POLBNPC1RAB9ASMN1; SMN2 | |
| SCHEMBL76588 | 0.87 | SMN1; SMN2 (0.54) | CA2POLBNPC1RAB9ASMN1; SMN2 | |
| SCHEMBL15738413 | 0.84 | TRPA1 (0.52) | CCR1TRPA1HTTCA2POLB | |
| SCHEMBL4680332 | 0.84 | CA2 (0.64) | CCR1TRPA1KDM4EGAAHTT | |
| SCHEMBL16234825 | 0.83 | TRPA1 (0.52) | TRPA1HTTS1PR4S1PR3 | |
| SCHEMBL77928 | 0.81 | NPC1 (0.56) | TRPA1GAAHTTCA2POLB | |
| SCHEMBL16234990 | 0.81 | CCR1 (0.60) | CCR1TRPA1KDM4EGAAHTT | |
| SCHEMBL16235034 | 0.81 | CCR1 (0.60) | CCR1TRPA1KDM4EGAAHTT | |
| SCHEMBL4678368 | 0.80 | HTT (0.53) | CCR1TRPA1KDM4EGAAHTT | |
| SCHEMBL30695663 | 0.80 | GAA (0.54) | CCR1TRPA1KDM4EGAAHTT |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2014184235-A1 | BENZAMIDE TRPA1 ANTAGONISTS | Acturum Life Science AB (SE) | 2014-11-20 | — | — | WO | claimed |
| WO-2014184235-A1 | BENZAMIDE TRPA1 ANTAGONISTS | Acturum Life Science AB (SE) | 2014-11-20 | — | — | WO | disclosed |