Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.57 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.57 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.57 |
| ▸ | DPP4 | P27487 | 3/20 | 0.47 |
| ▸ | LOXL2 | Q9Y4K0 | 1/20 | 0.46 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.44 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.43 |
| ▸ | DPP8 | Q6V1X1 | 1/20 | 0.42 |
| ▸ | IDO1 | P14902 | 5/20 | 0.41 |
| ▸ | AGXT | P21549 | 2/20 | 0.41 |
| ▸ | TDO2 | P48775 | 2/20 | 0.41 |
| ▸ | MAOB | P27338 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL12706134 | 1.00 | CYP1A2 (0.57) | CYP1A2CYP2D6CYP2C19DPP4LOXL2 | |
| Hydrochloric Acid SCHEMBL9734592 | 0.98 | CYP1A2 (0.55) | CYP1A2CYP2D6CYP2C19DPP4LOXL2 | |
| SCHEMBL7042096 | 0.90 | TAAR1 (0.50) | CYP1A2CYP2D6CYP2C19TAAR1 | |
| SCHEMBL3282141 | 0.90 | CYP2D6 (0.47) | CYP1A2CYP2D6CYP2C19LOXL2TAAR1 | |
| SCHEMBL3285416 | 0.90 | EPHX1 (0.50) | CYP1A2CYP2D6CYP2C19DPP4TAAR1 | |
| Hydrochloric Acid SCHEMBL9196881 | 0.88 | CYP2D6 (0.46) | CYP1A2CYP2D6CYP2C19LOXL2TAAR1 | |
| Hydrochloric Acid SCHEMBL9205510 | 0.88 | EPHX1 (0.48) | CYP1A2CYP2D6CYP2C19DPP4TAAR1 | |
| SCHEMBL7039221 | 0.86 | CYP1A2 (0.83) | CYP1A2CYP2D6CYP2C19 | |
| SCHEMBL7039339 | 0.84 | CYP1A2 (0.56) | CYP1A2CYP2D6CYP2C19DPP4MAOB | |
| SCHEMBL1500507 | 0.84 | DPP4 (0.46) | CYP1A2CYP2D6CYP2C19DPP4LOXL2 |
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 |
|---|---|---|---|---|---|---|---|
| US-5153198-A | Fluoro-diphenylethylpiperazine for treating nervous system and brain disorders | SANTEN PHARMACEUTICAL CO., LTD. (JP) | 1992-10-06 | — | — | US | disclosed |
| US-5087627-A | Administering diphenylethylpiperazine derivatives | SANTEN PHARMACEUTICAL CO., LTD. (JP) | 1992-02-11 | — | — | US | disclosed |