Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRPA1 | O75762 | 1/20 | 0.48 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.48 |
| ▸ | CACNA1C | Q13936 | 1/20 | 0.48 |
| ▸ | CA1 | P00915 | 2/20 | 0.44 |
| ▸ | CA2 | P00918 | 2/20 | 0.44 |
| ▸ | TP53 | P04637 | 2/20 | 0.44 |
| ▸ | TYR | P14679 | 2/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.44 |
| ▸ | ALOX12 | P18054 | 2/20 | 0.44 |
| ▸ | HTT | P42858 | 2/20 | 0.44 |
| ▸ | HDAC4 | P56524 | 2/20 | 0.44 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.44 |
| ▸ | MDM4 | O15151 | 1/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 1/20 | 0.44 |
| ▸ | HPGD | P15428 | 1/20 | 0.44 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.44 |
| ▸ | CA5A | P35218 | 1/20 | 0.44 |
| ▸ | MDM2 | Q00987 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL2869294 | 0.84 | TTR (0.56) | TRPA1PTGS1CACNA1CTYRALDH1A1 | |
| SCHEMBL6061209 | 0.80 | HPGD (0.46) | CA1CA2TP53TYRALDH1A1 | |
| SCHEMBL15462344 | 0.79 | TYR (0.46) | TRPA1PTGS1CACNA1CCA1CA2 | |
| SCHEMBL11974256 | 0.77 | TUBB4A (0.59) | TRPA1PTGS1CACNA1CCA1CA2 | |
| SCHEMBL17525663 | 0.76 | TRPA1 (0.53) | TRPA1PTGS1CACNA1CCA1CA2 | |
| SCHEMBL18197 | 0.76 | CA2 (0.62) | CA1CA2TP53ALDH1A1ALOX12 | |
| SCHEMBL12695025 | 0.76 | TRPA1 (0.53) | TRPA1PTGS1CACNA1CCA1CA2 | |
| SCHEMBL29446988 | 0.76 | CA2 (0.62) | CA1CA2TP53ALDH1A1ALOX12 | |
| SCHEMBL984086 | 0.76 | GABRA1 (0.59) | PTGS1CA1CA2TP53ALDH1A1 | |
| SCHEMBL7546534 | 0.76 | CA1 (0.48) | TRPA1CA1CA2TP53MAPT |
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-2002050008-A2 | NON-HALOGENATED PHENOXY AND/OR BENZYLOXY PHENOLS AND ANTIMICROBIAL COMPOSITIONS CONTAINING THEM | WARNER-LAMBERT COMPANY LLC (US) | 2002-06-27 | — | — | WO | claimed |
| WO-2002050008-A2 | NON-HALOGENATED PHENOXY AND/OR BENZYLOXY PHENOLS AND ANTIMICROBIAL COMPOSITIONS CONTAINING THEM | WARNER-LAMBERT COMPANY LLC (US) | 2002-06-27 | — | — | WO | disclosed |