Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.33 |
| ▸ | TACR1 | P25103 | 1/20 | 0.33 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.33 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.32 |
| ▸ | ITGA4 | P13612 | 1/20 | 0.31 |
| ▸ | ITGB7 | P26010 | 1/20 | 0.31 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.31 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.31 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.31 |
| ▸ | HTT | P42858 | 1/20 | 0.31 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.30 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL476455 | 0.90 | PTGDR2 (0.35) | PTGDR2TACR1HDAC1ROCK2ITGA4 | |
| SCHEMBL476410 | 0.86 | PRKAB2 (0.35) | PTGDR2TACR1HDAC1ROCK2HTT | |
| SCHEMBL476368 | 0.86 | PTGDR2 (0.35) | PTGDR2TACR1HDAC1ROCK2ITGA4 | |
| SCHEMBL476255 | 0.85 | PTGDR2 (0.34) | PTGDR2TACR1HDAC1ROCK2OPRM1 | |
| SCHEMBL476251 | 0.80 | PTGDR2 (0.32) | PTGDR2TACR1HDAC1ROCK2OPRM1 | |
| SCHEMBL476276 | 0.80 | CNR1 (0.41) | TACR1 | |
| SCHEMBL476315 | 0.79 | ROCK2 (0.35) | PTGDR2TACR1HDAC1ROCK2ITGA4 | |
| SCHEMBL476375 | 0.78 | CNR1 (0.37) | CHRM2CHRM1CHRM3 | |
| SCHEMBL476316 | 0.76 | CNR1 (0.37) | — | |
| SCHEMBL476234 | 0.76 | TP53 (0.36) | CHRM2CHRM1CHRM3 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2411383-A1 | DERIVATIVES OF 3-ALKOXY-4,5-DIARYLTHIOPHENE-2-CARBOXAMIDE, PREPARATION THEREOF, AND THERAPEUTIC USE THEREOF | SANOFI (FR) | 2012-02-01 | — | — | EP | claimed |
| WO-2010109150-A1 | DERIVATIVES OF 3-ALKOXY-4,5-DIARYLTHIOPHENE-2-CARBOXAMIDE, PREPARATION THEREOF, AND THERAPEUTIC USE THEREOF | SANOFI-AVENTIS (FR) | 2010-09-30 | — | — | WO | claimed |