Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD2 | P14416 | 8/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.39 |
| ▸ | ADRA2A | P08913 | 2/20 | 0.39 |
| ▸ | ADRA2B | P18089 | 2/20 | 0.39 |
| ▸ | ADRA2C | P18825 | 2/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.39 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | HTR1A | P08908 | 1/20 | 0.39 |
| ▸ | DRD4 | P21917 | 1/20 | 0.39 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.39 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL11233426 | 0.88 | DRD2 (0.44) | DRD2CYP1A2CYP3A4CYP2D6ADRA2A | |
| SCHEMBL11233253 | 0.83 | DRD2 (0.43) | DRD2CYP1A2CYP3A4CYP2D6ADRA2A | |
| SCHEMBL11222769 | 0.83 | DRD2 (0.35) | DRD2CYP1A2CYP3A4CYP2D6ADRA2A | |
| SCHEMBL11233235 | 0.81 | DRD2 (0.41) | DRD2CYP1A2CYP3A4CYP2D6ADRA2A | |
| SCHEMBL11236321 | 0.80 | DRD2 (0.46) | DRD2CYP1A2CYP3A4CYP2D6ADRA2A | |
| SCHEMBL11236938 | 0.80 | DRD2 (0.43) | DRD2CYP1A2CYP3A4CYP2D6ADRA2A | |
| SCHEMBL11281688 | 0.79 | SIGMAR1 (0.53) | CYP2D6ADRA2ATSHRKMT2ALMNA | |
| SCHEMBL11222634 | 0.78 | DRD2 (0.46) | DRD2CYP1A2CYP3A4CYP2D6ADRA2A | |
| SCHEMBL11230998 | 0.77 | DRD2 (0.43) | DRD2CYP1A2CYP3A4CYP2D6ADRA2A | |
| SCHEMBL11281691 | 0.76 | DRD2 (0.39) | DRD2MEN1KMT2ALMNAHTR1A |
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 |