Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD2 | P14416 | 7/20 | 0.39 |
| ▸ | LTA4H | P09960 | 4/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | OPRM1 | P35372 | 3/20 | 0.36 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.36 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.36 |
| ▸ | LMNA | P02545 | 2/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL11224223 | 0.91 | DRD2 (0.38) | DRD2LTA4HALDH1A1OPRM1LMNA | |
| SCHEMBL11238234 | 0.89 | DRD2 (0.41) | DRD2LTA4HALDH1A1OPRM1LMNA | |
| SCHEMBL11361910 | 0.84 | LMNA (0.47) | DRD2LTA4HALDH1A1OPRM1LMNA | |
| SCHEMBL11236302 | 0.84 | SIGMAR1 (0.56) | DRD2LTA4HALDH1A1OPRM1KCNH2 | |
| SCHEMBL11230155 | 0.83 | DRD2 (0.37) | DRD2LTA4HALDH1A1OPRM1LMNA | |
| Hydrochloric Acid SCHEMBL11369251 | 0.83 | MAPT (0.48) | DRD2LTA4HALDH1A1OPRM1LMNA | |
| SCHEMBL11220558 | 0.81 | DRD2 (0.40) | DRD2LTA4HALDH1A1OPRM1KCNH2 | |
| SCHEMBL11220600 | 0.80 | DRD2 (0.46) | DRD2OPRM1KCNH2SIGMAR1LMNA | |
| Fumaric Acid SCHEMBL11362525 | 0.78 | LMNA (0.44) | DRD2LTA4HALDH1A1OPRM1LMNA | |
| Maleic Acid SCHEMBL11362522 | 0.78 | LMNA (0.44) | DRD2LTA4HALDH1A1OPRM1LMNA |
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-4353901-A | HYPERTENSION, CONGESTIVE HEART FAILURE, ARRHYTHMIAMIGRAINE, VASOSPASTIC DISORDERS, ASTHMA | SYNTEX (U.S.A.) INC. (US) | 1982-10-12 | — | — | US | disclosed |