Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA2 | P00918 | 5/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.45 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 4/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.42 |
| ▸ | ATM | Q13315 | 1/20 | 0.42 |
| ▸ | CA1 | P00915 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.39 |
| ▸ | GLA | P06280 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | GPR84 | Q9NQS5 | 3/20 | 0.37 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | SLC1A3 | P43003 | 1/20 | 0.37 |
| ▸ | SLC1A2 | P43004 | 1/20 | 0.37 |
| ▸ | SLC1A1 | P43005 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL29523183 | 0.96 | TSHR (0.44) | CA2ALDH1A1MAPK1TSHRCYP3A4 | |
| SCHEMBL108345 | 0.96 | TSHR (0.44) | CA2ALDH1A1MAPK1TSHRCYP3A4 | |
| SCHEMBL7878129 | 0.96 | CA2 (0.46) | CA2ALDH1A1MAPK1TSHRCYP3A4 | |
| Acetone SCHEMBL10535239 | 0.93 | TSHR (0.41) | CA2ALDH1A1MAPK1TSHRCYP3A4 | |
| SCHEMBL14989251 | 0.89 | CA2 (0.44) | CA2ALDH1A1MAPK1TSHRCYP3A4 | |
| SCHEMBL23646642 | 0.87 | CA2 (0.42) | CA2ALDH1A1MAPK1TSHRCYP3A4 | |
| SCHEMBL14989115 | 0.87 | CA2 (0.41) | CA2ALDH1A1MAPK1TSHRCYP3A4 | |
| SCHEMBL20920808 | 0.87 | CA2 (0.41) | CA2ALDH1A1MAPK1TSHRCYP3A4 | |
| SCHEMBL10774869 | 0.87 | CA2 (0.39) | CA2ALDH1A1MAPK1TSHRCYP3A4 | |
| Benzoic Acid SCHEMBL15918863 | 0.85 | ALDH1A1 (0.47) | CA2ALDH1A1MAPK1TSHRCYP3A4 |
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-1567470-B1 | HYDROGENATION OF BENZENE POLYCARBOXYLIC ACIDS OR DERIVATIVES THEREOF | EXXONMOBIL CHEM PATENTS INC (US) | 2013-06-05 | — | — | EP | claimed |
| EP-0693254-A1 | Gel formulations containing insecticides for vaporizer systems | BAYER AG (DE) | 1996-01-24 | — | — | EP | disclosed |