Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD2 | P14416 | 3/20 | 0.39 |
| ▸ | DRD3 | P35462 | 3/20 | 0.39 |
| ▸ | HTR2A | P28223 | 2/20 | 0.39 |
| ▸ | HTR2C | P28335 | 2/20 | 0.39 |
| ▸ | HTR6 | P50406 | 2/20 | 0.39 |
| ▸ | SKP2 | Q13309 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.35 |
| ▸ | CA2 | P00918 | 2/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | NPC1 | O15118 | 1/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.34 |
| ▸ | HTT | P42858 | 1/20 | 0.34 |
| ▸ | RAB9A | P51151 | 1/20 | 0.34 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL9684037 | 0.95 | S1PR1 (0.38) | DRD2DRD3HTR2AHTR2CHTR6 | |
| SCHEMBL9685749 | 0.91 | CNR1 (0.36) | DRD2DRD3HTR2AHTR2CHTR6 | |
| SCHEMBL7760492 | 0.87 | — | — | |
| SCHEMBL9684946 | 0.85 | BCHE (0.37) | CA2S1PR1 | |
| SCHEMBL9437752 | 0.85 | THRA (0.31) | S1PR1THRATHRB | |
| SCHEMBL9449597 | 0.85 | SIGMAR1 (0.55) | CYP1A2CYP2D6SIGMAR1 | |
| Hydrochloric Acid SCHEMBL8870829 | 0.84 | TLR8 (0.35) | HTR2ACYP1A2CYP2D6CYP2C19SIGMAR1 | |
| SCHEMBL9684023 | 0.84 | KDM4E (0.35) | CYP1A2SMN1; SMN2NPC1HTTRAB9A | |
| SCHEMBL8114240 | 0.83 | KDM4E (0.37) | DRD2DRD3CYP1A2CYP3A4CYP2D6 | |
| SCHEMBL7761425 | 0.83 | GRIA2 (0.31) | — |
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-5084469-A | Analgesics | ADIR ET COMPAGNIE (FR) | 1992-01-28 | — | — | US | disclosed |