Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 2/20 | 0.73 |
| ▸ | CA1 | P00915 | 2/20 | 0.73 |
| ▸ | CA2 | P00918 | 2/20 | 0.73 |
| ▸ | CA3 | P07451 | 2/20 | 0.73 |
| ▸ | CA4 | P22748 | 2/20 | 0.73 |
| ▸ | CA9 | Q16790 | 2/20 | 0.73 |
| ▸ | CA14 | Q9ULX7 | 2/20 | 0.73 |
| ▸ | GLA | P06280 | 1/20 | 0.73 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.73 |
| ▸ | MMP3 | P08254 | 1/20 | 0.50 |
| ▸ | BCL2L1 | Q07817 | 1/20 | 0.50 |
| ▸ | ESR1 | P03372 | 12/20 | 0.48 |
| ▸ | ESR2 | Q92731 | 8/20 | 0.48 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.46 |
| ▸ | TP53 | P04637 | 2/20 | 0.45 |
| ▸ | MEN1 | O00255 | 3/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.44 |
| ▸ | NPC1 | O15118 | 2/20 | 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 | |
|---|---|---|---|---|
| Phenol SCHEMBL6276419 | 1.00 | CA12 (0.73) | CA12CA1CA2CA3CA4 | |
| Phenol SCHEMBL1885111 | 1.00 | CA12 (0.73) | CA12CA1CA2CA3CA4 | |
| Phenol SCHEMBL27849524 | 1.00 | CA12 (0.73) | CA12CA1CA2CA3CA4 | |
| Phenol SCHEMBL27757780 | 0.97 | CA12 (0.69) | CA12CA1CA2CA3CA4 | |
| Phenol SCHEMBL15667082 | 0.91 | TDP1 (0.61) | CA12CA1CA2CA3CA4 | |
| Biphenyl SCHEMBL27496105 | 0.91 | MMP3 (0.65) | CA12CA1CA2CA3CA4 | |
| Phenol SCHEMBL28149362 | 0.91 | TDP1 (0.61) | CA12CA1CA2CA3CA4 | |
| Phenol SCHEMBL27342954 | 0.91 | CA12 (0.61) | CA12CA1CA2CA3CA4 | |
| Phenol SCHEMBL919188 | 0.90 | CA12 (0.69) | CA12CA1CA2CA3CA4 | |
| Phenol SCHEMBL247463 | 0.90 | CA12 (0.69) | CA12CA1CA2CA3CA4 |
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 |
|---|---|---|---|---|---|---|---|
| CN-100387564-C | Method and apparatus of adjusting diphenol propane concentration in two-step crystallization purification method | WUXI RESIN FACTORY OF BLUE STA (CN) | 2008-05-14 | — | — | CN | disclosed |
| CN-1927796-A | Method and apparatus of adjusting diphenol propane concentration in two-step crystallization purification method | WUXI RESIN FACTORY OF BLUE STA (CN) | 2007-03-14 | — | — | CN | disclosed |