Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
| ▸ | MAOB | P27338 | 3/20 | 0.42 |
| ▸ | HPGD | P15428 | 2/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.42 |
| ▸ | BLM | P54132 | 1/20 | 0.42 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.42 |
| ▸ | RAB9A | P51151 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | HTT | P42858 | 1/20 | 0.42 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.42 |
| ▸ | PPARG | P37231 | 1/20 | 0.42 |
| ▸ | PPARA | Q07869 | 1/20 | 0.42 |
| ▸ | DRD4 | P21917 | 2/20 | 0.41 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.41 |
| ▸ | DRD2 | P14416 | 1/20 | 0.41 |
| ▸ | DRD3 | P35462 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL18493755 | 0.83 | ALDH1A1 (0.50) | CYP3A4KMT2AMEN1ALDH1A1L3MBTL1 | |
| SCHEMBL18493762 | 0.81 | PKM (0.53) | CYP1A2CYP3A4CYP2C19HPGDKMT2A | |
| SCHEMBL1345118 | 0.79 | MAOB (0.57) | MAOBRAB9ANPSR1DRD4KCNH2 | |
| SCHEMBL18493757 | 0.79 | INPPL1 (0.44) | CYP2C19L3MBTL1 | |
| SCHEMBL18493759 | 0.76 | PKM (0.49) | KMT2ARAB9AALDH1A1NPC1 | |
| SCHEMBL11440679 | 0.74 | FDPS (0.48) | CYP1A2CYP3A4CYP2C19MAOBHPGD | |
| SCHEMBL11334520 | 0.74 | MAOB (0.64) | MAOBKMT2ARAB9AMEN1DRD4 | |
| SCHEMBL11585119 | 0.73 | DRD4 (0.53) | MAOBRAB9AALDH1A1NPSR1DRD4 | |
| SCHEMBL3771178 | 0.73 | CYP1A2 (0.53) | CYP1A2CYP3A4CYP2C19HPGDKMT2A | |
| SCHEMBL9770319 | 0.73 | DRD4 (0.59) | RAB9AALDH1A1NPSR1DRD4KCNH2 |
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-4231781-A | Halophenoxy-alkoxy phosphonates and thiophosphonates | GAF CORPORATION (US) | 1980-11-04 | — | — | US | disclosed |