Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TEAD1 | P28347 | 2/20 | 0.41 |
| ▸ | TEAD4 | Q15561 | 2/20 | 0.41 |
| ▸ | TEAD2 | Q15562 | 2/20 | 0.41 |
| ▸ | TRPA1 | O75762 | 2/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.34 |
| ▸ | TEAD3 | Q99594 | 1/20 | 0.33 |
| ▸ | MAPK10 | P53779 | 3/20 | 0.33 |
| ▸ | MAPK8 | P45983 | 2/20 | 0.33 |
| ▸ | MAPK14 | Q16539 | 2/20 | 0.33 |
| ▸ | ESR1 | P03372 | 1/20 | 0.33 |
| ▸ | PGR | P06401 | 1/20 | 0.33 |
| ▸ | HTR2A | P28223 | 1/20 | 0.33 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.33 |
| ▸ | TRPC5 | Q9UL62 | 1/20 | 0.33 |
| ▸ | DDB1 | Q16531 | 1/20 | 0.32 |
| ▸ | CRBN | Q96SW2 | 1/20 | 0.32 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.32 |
| ▸ | FKBP1A | P62942 | 1/20 | 0.31 |
| ▸ | GLA | P06280 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 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 | |
|---|---|---|---|---|
| SCHEMBL14673 | 1.00 | TEAD1 (0.41) | TEAD1TEAD4TEAD2TRPA1POLB | |
| SCHEMBL12190 | 0.89 | TEAD1 (0.41) | TEAD1TEAD4TEAD2TRPA1POLB | |
| SCHEMBL11854 | 0.74 | ALDH1A1 (0.39) | TEAD1TEAD4TEAD2TRPA1POLB | |
| SCHEMBL10309 | 0.72 | POLB (0.43) | TEAD1TEAD4TEAD2TRPA1POLB | |
| SCHEMBL24896368 | 0.72 | BACE1 (0.44) | POLBMAPK10MAPK8MAPK14DDB1 | |
| SCHEMBL14328365 | 0.68 | ALDH1A1 (0.43) | TRPA1POLBMAPK14ESR1PGR | |
| SCHEMBL10168 | 0.68 | POLB (0.38) | TEAD1TEAD4TEAD2TRPA1POLB | |
| SCHEMBL488077 | 0.68 | MAPK1 (0.44) | POLBMAPK10MAPK8MAPK14DDB1 | |
| SCHEMBL14609 | 0.65 | ALDH1A1 (0.49) | TEAD1TEAD4TEAD2TRPA1POLB | |
| SCHEMBL22271628 | 0.64 | ALDH1A1 (0.47) | TEAD1TEAD4TEAD2TRPA1POLB |
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-2011043954-A1 | NOVEL TRPA1 ANTAGONISTS | MERCK SHARP & DOHME CORP. (US) | 2011-04-14 | — | — | WO | disclosed |