Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAAR1 | Q96RJ0 | 2/20 | 0.42 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.36 |
| ▸ | RECQL | P46063 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.35 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.35 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.34 |
| ▸ | ATM | Q13315 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | NPY2R | P49146 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | KIF11 | P52732 | 1/20 | 0.33 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.33 |
| ▸ | KCNA5 | P22460 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL14910579 | 0.85 | TAAR1 (0.56) | TAAR1SLC6A2CYP2C19CYP1A2CYP2C9 | |
| SCHEMBL10417846 | 0.85 | TAAR1 (0.56) | TAAR1SLC6A2CYP2C19CYP1A2CYP2C9 | |
| SCHEMBL8974025 | 0.84 | ESR1 (0.47) | TAAR1SLC6A2CYP2C19CYP1A2CYP2C9 | |
| SCHEMBL8480315 | 0.82 | TSHR (0.41) | KIF11ESR1ESR2 | |
| SCHEMBL27969023 | 0.81 | CYP1A2 (0.45) | TAAR1SLC6A2CYP2C19CYP1A2CYP2C9 | |
| SCHEMBL28924891 | 0.81 | TAAR1 (0.39) | TAAR1SLC6A2CYP2C19CYP1A2CYP2C9 | |
| SCHEMBL8477968 | 0.78 | ALDH1A1 (0.38) | TAAR1LMNACYP3A4RECQLMAPK1 | |
| SCHEMBL8474416 | 0.77 | TAAR1 (0.32) | TAAR1SLC6A2CYP2C19CYP1A2CYP2C9 | |
| SCHEMBL3033365 | 0.76 | ESR1 (0.47) | TAAR1SLC6A2CYP2C19CYP1A2CYP2C9 | |
| SCHEMBL8477408 | 0.76 | CYP2C9 (0.51) | CYP2C19CYP1A2CYP2C9CYP2D6LMNA |
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-6004988-A | Carboxylic acid derivatives, their preparation and their use | BASF AKTIENGESELLSCHAFT (DE) | 1999-12-21 | — | — | US | disclosed |