Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.49 |
| ▸ | GNAI3 | P08754 | 2/20 | 0.48 |
| ▸ | GNAO1 | P09471 | 2/20 | 0.48 |
| ▸ | GNAI1 | P63096 | 2/20 | 0.48 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | HTT | P42858 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | SLC2A1 | P11166 | 1/20 | 0.43 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.42 |
| ▸ | DRD2 | P14416 | 2/20 | 0.41 |
| ▸ | DRD4 | P21917 | 2/20 | 0.41 |
| ▸ | DRD3 | P35462 | 2/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL27483203 | 0.99 | GNAI3 (0.50) | KDM4EGNAI3GNAO1GNAI1CYP1A2 | |
| SCHEMBL17484553 | 0.90 | KDM4E (0.54) | KDM4ECYP1A2CYP2D6CYP2C19LMNA | |
| SCHEMBL7787085 | 0.86 | KDM4E (0.61) | KDM4EGNAI3GNAO1GNAI1CYP1A2 | |
| SCHEMBL6652163 | 0.85 | GNAI3 (0.44) | KDM4EGNAI3GNAO1GNAI1CYP1A2 | |
| SCHEMBL8553914 | 0.80 | USP2 (0.58) | KDM4ECYP1A2CYP2D6CYP2C19MEN1 | |
| SCHEMBL17484496 | 0.77 | GRIN2B (0.48) | GNAI3GNAO1GNAI1 | |
| SCHEMBL2233187 | 0.76 | MAOB (0.43) | — | |
| SCHEMBL3467991 | 0.74 | KDM4E (0.51) | KDM4ECYP1A2CYP2D6CYP2C19HRH3 | |
| SCHEMBL8484170 | 0.74 | HTR1A (0.54) | HRH3DRD2DRD3 | |
| SCHEMBL4329812 | 0.73 | ITGB3 (0.49) | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-1143971-B1 | SUBSTITUTED 1-(PIPERIDIN-4-YL)-3-(ARYL)-ISOTHIOUREAS, THEIR PREPARATION AND THERAPEUTIC USE | PF MEDICAMENT (FR) | 2004-06-02 | — | — | EP | disclosed |