Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRPA1 | O75762 | 1/20 | 0.39 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.39 |
| ▸ | CACNA1C | Q13936 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.36 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | CES2 | O00748 | 1/20 | 0.35 |
| ▸ | CES1 | P23141 | 1/20 | 0.35 |
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.35 |
| ▸ | TP53 | P04637 | 1/20 | 0.35 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.34 |
| ▸ | PRSS2 | P07478 | 1/20 | 0.34 |
| ▸ | PRSS3 | P35030 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL17086648 | 0.80 | ABCB11 (0.50) | TRPA1PTGS1CACNA1CTDP1ALDH1A1 | |
| SCHEMBL28704040 | 0.80 | CYP3A4 (0.50) | TRPA1PTGS1CACNA1CSMN1; SMN2TDP1 | |
| SCHEMBL11705337 | 0.79 | SMN1; SMN2 (0.43) | TRPA1PTGS1CACNA1CSMN1; SMN2TDP1 | |
| SCHEMBL3636225 | 0.78 | ALDH1A1 (0.38) | TRPA1PTGS1CACNA1CSMN1; SMN2ALDH1A1 | |
| SCHEMBL11705367 | 0.76 | TAS1R3 (0.40) | TRPA1PTGS1CACNA1CSMN1; SMN2TDP1 | |
| SCHEMBL9570752 | 0.74 | ESR1 (0.37) | TRPA1PTGS1CACNA1CSMN1; SMN2ALDH1A1 | |
| SCHEMBL14182599 | 0.73 | TRPA1 (0.43) | TRPA1PTGS1CACNA1CSMN1; SMN2TDP1 | |
| SCHEMBL822085 | 0.73 | TRPA1 (0.43) | TRPA1PTGS1CACNA1CTDP1ALDH1A1 | |
| SCHEMBL29403039 | 0.73 | TRPA1 (0.43) | TRPA1PTGS1CACNA1CTDP1ALDH1A1 | |
| SCHEMBL5307487 | 0.73 | POLB (0.41) | SMN1; SMN2TDP1ALDH1A1POLBNR1H4 |
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-1678185-A1 | 2,3-DIHYDRO-6-NITROIMIDAZO [2,1-B] OXAZOLE COMPOUNDS FOR THE TREATMENT OF TUBERCULOSIS | OTSUKA PHARMACEUTICAL CO., LTD. (JP) | 2006-07-12 | — | — | EP | disclosed |
| WO-2005042542-A1 | 2,3-DIHYDRO-6-NITROIMIDAZO (2,1-B) OXAZOLE COMPOUNDS FOR THE TREATMENT OF TUBERCULOSIS | OTSUKA PHARMACEUTICAL CO., LTD. (JP) | 2005-05-12 | — | — | WO | disclosed |