Known targets — ChEMBL curated mechanism
ACHECHRM1CHRM3CHRNA1CHRNB1CHRNDCHRNECHRNG
The experimentally established mechanism targets of Phenol. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 1/20 | 0.50 |
| ▸ | CA1 | P00915 | 1/20 | 0.50 |
| ▸ | CA2 | P00918 | 1/20 | 0.50 |
| ▸ | GLA | P06280 | 1/20 | 0.50 |
| ▸ | CA3 | P07451 | 1/20 | 0.50 |
| ▸ | CA4 | P22748 | 1/20 | 0.50 |
| ▸ | CA9 | Q16790 | 1/20 | 0.50 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.50 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.50 |
| ▸ | MMP3 | P08254 | 1/20 | 0.37 |
| ▸ | BCL2L1 | Q07817 | 1/20 | 0.37 |
| ▸ | ESR1 | P03372 | 11/20 | 0.36 |
| ▸ | ESR2 | Q92731 | 7/20 | 0.36 |
| ▸ | PDCD1 | Q15116 | 1/20 | 0.36 |
| ▸ | CD274 | Q9NZQ7 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | TYR | P14679 | 1/20 | 0.33 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.33 |
| ▸ | GABRB2 | P47870 | 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 | |
|---|---|---|---|---|
| Phenol SCHEMBL1679512 | 0.95 | CA12 (0.55) | CA12CA1CA2GLACA3 | |
| Phenol SCHEMBL1679490 | 0.93 | CA12 (0.58) | CA12CA1CA2GLACA3 | |
| Phenol SCHEMBL19371818 | 0.86 | CA12 (0.50) | CA12CA1CA2GLACA3 | |
| Phenol SCHEMBL3487571 | 0.82 | CA12 (0.41) | CA12CA1CA2GLACA3 | |
| Trifluoroacetic Acid SCHEMBL3190348 | 0.81 | CA12 (0.39) | CA12CA1CA2GLACA3 | |
| Metacresol SCHEMBL7067179 | 0.81 | ACHE (0.61) | CA12CA1CA2GLACA3 | |
| Phenol SCHEMBL27681918 | 0.77 | CA12 (0.73) | CA12CA1CA2GLACA3 | |
| Phenol SCHEMBL28134208 | 0.77 | — | — | |
| Phenol SCHEMBL7115665 | 0.75 | CA12 (0.61) | CA12CA1CA2GLACA3 | |
| Phenol SCHEMBL20741797 | 0.75 | CA12 (0.61) | CA12CA1CA2GLACA3 |
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-1476465-A1 | METHOD FOR PRODUCING INTERFERON | RMF DICTAGENE S.A. (CH) | 2004-11-17 | — | — | EP | disclosed |
| WO-2003070764-A1 | METHOD FOR PRODUCING INTERFERON | RMF DICTAGENE S.A. (CH) | 2003-08-28 | — | — | WO | disclosed |