Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2A | P28223 | 1/20 | 0.48 |
| ▸ | HTR2C | P28335 | 1/20 | 0.48 |
| ▸ | HTR2B | P41595 | 1/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.46 |
| ▸ | BAZ2B | Q9UIF8 | 1/20 | 0.46 |
| ▸ | SCN1A | P35498 | 2/20 | 0.44 |
| ▸ | SCN2A | Q99250 | 2/20 | 0.44 |
| ▸ | SCN3A | Q9NY46 | 2/20 | 0.44 |
| ▸ | HTT | P42858 | 1/20 | 0.44 |
| ▸ | ADH5 | P11766 | 1/20 | 0.42 |
| ▸ | TBXAS1 | P24557 | 2/20 | 0.41 |
| ▸ | HRH3 | Q9Y5N1 | 5/20 | 0.41 |
| ▸ | GPR119 | Q8TDV5 | 1/20 | 0.41 |
| ▸ | TERT | O14746 | 2/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | ABCC9 | O60706 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL10511201 | 0.82 | DRD3 (0.62) | HTR2AHTR2CHTR2BCYP3A4BAZ2B | |
| SCHEMBL10573127 | 0.81 | TBXAS1 (0.44) | HTR2AHTR2CHTR2BCYP3A4BAZ2B | |
| Hydrochloric Acid SCHEMBL10573496 | 0.80 | DRD3 (0.60) | HTR2AHTR2CHTR2BCYP3A4BAZ2B | |
| SCHEMBL10572053 | 0.72 | CYP3A4 (0.56) | HTR2AHTR2CHTR2BCYP3A4BAZ2B | |
| SCHEMBL8699130 | 0.71 | TBXAS1 (0.47) | SCN1ASCN2ASCN3ATBXAS1 | |
| SCHEMBL4944365 | 0.71 | SCN1A (0.60) | SCN1ASCN2ASCN3AHRH3 | |
| Hydrochloric Acid SCHEMBL10511785 | 0.71 | CYP3A4 (0.55) | HTR2AHTR2CHTR2BCYP3A4BAZ2B | |
| SCHEMBL9310898 | 0.71 | HTT (0.61) | HTR2AHTR2CHTR2BCYP3A4BAZ2B | |
| SCHEMBL10622131 | 0.70 | TBXAS1 (0.63) | HTR2AHTR2CHTR2BCYP3A4BAZ2B | |
| Hydrochloric Acid SCHEMBL9585712 | 0.70 | KCNH2 (0.53) | HTR2AHTR2CHTR2BCYP3A4HRH3 |
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-4851526-A | ANTIARRYTHMIA, HYPOTENSIVE, ANTIISCHEMIC | SCHERING A.G. (DE) | 1989-07-25 | — | — | US | disclosed |