Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD2 | P14416 | 1/20 | 0.55 |
| ▸ | DRD4 | P21917 | 1/20 | 0.55 |
| ▸ | DRD3 | P35462 | 1/20 | 0.55 |
| ▸ | CTSS | P25774 | 12/20 | 0.53 |
| ▸ | NPC1 | O15118 | 1/20 | 0.49 |
| ▸ | RAB9A | P51151 | 1/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.49 |
| ▸ | ACHE | P22303 | 2/20 | 0.45 |
| ▸ | DHFR | P00374 | 1/20 | 0.45 |
| ▸ | EGFR | P00533 | 1/20 | 0.45 |
| ▸ | ERBB2 | P04626 | 1/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.44 |
| ▸ | RCE1 | Q9Y256 | 1/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.43 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL9720664 | 0.93 | DRD2 (0.62) | DRD2DRD4DRD3CTSS | |
| Hydrochloric Acid SCHEMBL10644520 | 0.86 | DRD2 (0.56) | DRD2DRD4DRD3CTSSGRIN2B | |
| SCHEMBL8963868 | 0.84 | DRD2 (0.63) | DRD2DRD4DRD3CTSSSMN1; SMN2 | |
| SCHEMBL9725056 | 0.82 | DRD4 (0.67) | DRD2DRD4DRD3CTSSACHE | |
| SCHEMBL8964084 | 0.82 | DRD2 (0.52) | DRD2DRD4DRD3CTSSSMN1; SMN2 | |
| SCHEMBL9720670 | 0.81 | DRD4 (0.57) | DRD2DRD4DRD3CTSSSMN1; SMN2 | |
| SCHEMBL9425835 | 0.81 | DRD2 (0.54) | DRD2DRD4DRD3CTSSSMN1; SMN2 | |
| SCHEMBL8963961 | 0.80 | DRD2 (0.58) | DRD2DRD4DRD3CTSS | |
| Lifarizine SCHEMBL676318 | 0.79 | DRD2 (0.57) | DRD2DRD4DRD3CTSSSMN1; SMN2 | |
| SCHEMBL8963501 | 0.78 | CTSS (0.52) | DRD2DRD4DRD3CTSSSMN1; SMN2 |
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-5142052-A | Cationic effect-driven carbinol/amine reaction | LABORATOIRES SYNTEX (FR) | 1992-08-25 | — | — | US | disclosed |