Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRM2 | Q14416 | 1/20 | 0.40 |
| ▸ | GRM3 | Q14832 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.38 |
| ▸ | CTBP2 | P56545 | 1/20 | 0.37 |
| ▸ | HPGD | P15428 | 1/20 | 0.37 |
| ▸ | RIPK1 | Q13546 | 2/20 | 0.36 |
| ▸ | CA1 | P00915 | 2/20 | 0.36 |
| ▸ | CA2 | P00918 | 2/20 | 0.36 |
| ▸ | PPARG | P37231 | 1/20 | 0.36 |
| ▸ | PPARA | Q07869 | 1/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.35 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | APEX1 | P27695 | 1/20 | 0.35 |
| ▸ | EGFR | P00533 | 2/20 | 0.35 |
| ▸ | ERBB2 | P04626 | 2/20 | 0.35 |
| ▸ | CA12 | O43570 | 1/20 | 0.35 |
| ▸ | CA9 | Q16790 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL5674360 | 0.89 | CES1 (0.39) | GRM2GRM3CA1CA12CA9 | |
| SCHEMBL11016084 | 0.87 | CTBP2 (0.42) | CTBP2FFAR1EGFRERBB2 | |
| SCHEMBL7722455 | 0.77 | ALDH1A1 (0.39) | GRM2GRM3CA1CA2TDP1 | |
| SCHEMBL11015622 | 0.75 | — | — | |
| SCHEMBL8841188 | 0.73 | GRM2 (0.50) | GRM2GRM3KDM4ES1PR1HPGD | |
| SCHEMBL7721716 | 0.72 | CA12 (0.39) | KDM4ERIPK1CA1CA12CA9 | |
| SCHEMBL24440186 | 0.72 | GRM2 (0.47) | GRM2GRM3KDM4ES1PR1CTBP2 | |
| SCHEMBL13520471 | 0.70 | GRM2 (0.50) | GRM2GRM3KDM4ES1PR1HPGD | |
| SCHEMBL24440172 | 0.70 | GRM2 (0.50) | GRM2GRM3KDM4ES1PR1HPGD | |
| SCHEMBL7022118 | 0.69 | PPARG (0.40) | PPARGPPARATDP1 |
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 |
|---|---|---|---|---|---|---|---|
| US-4525301-A | REACTING TRIFLUOROMETHANE SULFONIC ACID DERIVATIVES WITH AMINO ACID ESTERS | HOECHST AKTIENGESELLSCHAFT (DE) | 1985-06-25 | — | — | US | disclosed |