Known targets — ChEMBL curated mechanism
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 | 4/20 | 0.73 |
| ▸ | CA1 | P00915 | 4/20 | 0.73 |
| ▸ | CA2 | P00918 | 4/20 | 0.73 |
| ▸ | CA9 | Q16790 | 4/20 | 0.73 |
| ▸ | CA3 | P07451 | 3/20 | 0.73 |
| ▸ | CA4 | P22748 | 3/20 | 0.73 |
| ▸ | CA14 | Q9ULX7 | 3/20 | 0.73 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.73 |
| ▸ | GLA | P06280 | 1/20 | 0.73 |
| ▸ | CES2 | O00748 | 2/20 | 0.55 |
| ▸ | MMP3 | P08254 | 1/20 | 0.50 |
| ▸ | BCL2L1 | Q07817 | 1/20 | 0.50 |
| ▸ | MEN1 | O00255 | 2/20 | 0.48 |
| ▸ | LMNA | P02545 | 2/20 | 0.48 |
| ▸ | MAPT | P10636 | 2/20 | 0.48 |
| ▸ | RAB9A | P51151 | 2/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.48 |
| ▸ | MAOA | P21397 | 1/20 | 0.48 |
| ▸ | MAOB | P27338 | 1/20 | 0.48 |
| ▸ | FNTA | P49354 | 1/20 | 0.48 |
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 SCHEMBL11136299 | 0.97 | CA12 (0.79) | CA12CA1CA2CA9CA3 | |
| Phenol SCHEMBL7570924 | 0.97 | CA12 (0.79) | CA12CA1CA2CA9CA3 | |
| Phenol SCHEMBL27804994 | 0.97 | CA12 (0.79) | CA12CA1CA2CA9CA3 | |
| Phenol SCHEMBL28089474 | 0.97 | CA12 (0.79) | CA12CA1CA2CA9CA3 | |
| Phenol SCHEMBL252449 | 0.97 | CA12 (0.79) | CA12CA1CA2CA9CA3 | |
| Phenol SCHEMBL1975546 | 0.97 | CA12 (0.79) | CA12CA1CA2CA9CA3 | |
| Phenol SCHEMBL27928055 | 0.97 | CA12 (0.79) | CA12CA1CA2CA9CA3 | |
| Phenol SCHEMBL7183126 | 0.97 | CA12 (0.79) | CA12CA1CA2CA9CA3 | |
| Phenol SCHEMBL10392313 | 0.93 | CA12 (0.73) | CA12CA1CA2CA9CA3 | |
| Phenol SCHEMBL11095407 | 0.93 | CA12 (0.73) | CA12CA1CA2CA9CA3 |
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 |
|---|---|---|---|---|---|---|---|
| JP-7018138-A | — | — | None | — | — | JP | disclosed |
| JP-H0718138-A | HALOGEN-CONTAINING RESIN COMPOSITION HAVING EXCELLENT PROCESSABILITY | KYODO YAKUHIN KK | 1995-01-20 | — | — | JP | disclosed |