Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | NQO2 | P16083 | 1/20 | 0.32 |
| ▸ | CA12 | O43570 | 1/20 | 0.31 |
| ▸ | CA1 | P00915 | 1/20 | 0.31 |
| ▸ | CA2 | P00918 | 1/20 | 0.31 |
| ▸ | GLA | P06280 | 1/20 | 0.31 |
| ▸ | CA3 | P07451 | 1/20 | 0.31 |
| ▸ | CA4 | P22748 | 1/20 | 0.31 |
| ▸ | CA9 | Q16790 | 1/20 | 0.31 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.31 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.31 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.30 |
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 SCHEMBL2680673 | 1.00 | ALDH1A1 (0.32) | ALDH1A1NQO2CA12CA1CA2 | |
| Phenol SCHEMBL6132262 | 0.83 | CA1 (0.44) | ALDH1A1CA12CA1CA2GLA | |
| Phenol SCHEMBL9746501 | 0.80 | CA2 (0.48) | ALDH1A1NQO2CA12CA1CA2 | |
| Phenol SCHEMBL11573677 | 0.77 | CA12 (0.41) | ALDH1A1NQO2CA12CA1CA2 | |
| Phenol SCHEMBL106766 | 0.75 | NQO2 (0.32) | ALDH1A1NQO2CA12CA1CA2 | |
| Phenol SCHEMBL5611358 | 0.71 | NQO2 (0.33) | NQO2CA12CA1CA2GLA | |
| Pentabromophenol SCHEMBL9406870 | 0.69 | ALDH1A1 (0.43) | ALDH1A1CA1CA2CA4ALOX15 | |
| SCHEMBL9824854 | 0.67 | TSHR (0.54) | ALDH1A1CA1CA2CA9 | |
| SCHEMBL30479640 | 0.67 | PTPN1 (0.46) | ALDH1A1NQO2CA1CA2CA4 | |
| SCHEMBL144299 | 0.67 | PTPN1 (0.46) | ALDH1A1NQO2CA1CA2CA4 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2003106547-A2 | FLAMEPROOFING AGENT COMPOSITIONS FOR POLYOLEFIN SEMIFINISHED PRODUCTS AND POLYOLEFIN MOLDING MATERIALS | AGROLINZ MELAMIN GMBH (AT) | 2003-12-24 | — | — | WO | disclosed |