Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAB9A | P51151 | 4/20 | 0.46 |
| ▸ | NPC1 | O15118 | 4/20 | 0.46 |
| ▸ | HPGD | P15428 | 2/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.42 |
| ▸ | CYP2E1 | P05181 | 1/20 | 0.42 |
| ▸ | CYP2C8 | P10632 | 1/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.42 |
| ▸ | CYP2B6 | P20813 | 1/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.41 |
| ▸ | MAPT | P10636 | 3/20 | 0.41 |
| ▸ | MEN1 | O00255 | 3/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.41 |
| ▸ | LMNA | P02545 | 2/20 | 0.41 |
| ▸ | HTT | P42858 | 2/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL8380671 | 0.89 | HTT (0.44) | RAB9ANPC1ALDH1A1CYP1A2CYP3A4 | |
| SCHEMBL8381287 | 0.83 | MAPT (0.40) | RAB9ANPC1ALDH1A1CYP1A2CYP3A4 | |
| Water SCHEMBL8385074 | 0.83 | MAPT (0.45) | RAB9ANPC1HPGDALDH1A1CYP1A2 | |
| Water SCHEMBL8379647 | 0.82 | MAPT (0.39) | RAB9ANPC1ALDH1A1CYP1A2CYP3A4 | |
| SCHEMBL8384646 | 0.81 | HPGD (0.41) | RAB9AHPGDALDH1A1MAPTMEN1 | |
| SCHEMBL8379431 | 0.81 | MAOA (0.37) | ALDH1A1MAPTMEN1KMT2ACBFB | |
| SCHEMBL8384586 | 0.80 | FABP6 (0.45) | RAB9ANPC1ALDH1A1MAPK1MAPT | |
| SCHEMBL8379290 | 0.79 | MEN1 (0.36) | RAB9ANPC1ALDH1A1CYP1A2CYP3A4 | |
| SCHEMBL8382787 | 0.78 | KMT2A (0.58) | RAB9ANPC1HPGDALDH1A1CYP1A2 | |
| SCHEMBL8379364 | 0.78 | ATP4A (0.38) | HPGDALDH1A1MAPTMEN1KMT2A |
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-5945425-A | ADENOSINE TRIPHOSPHASE INHIBITOR; DNA VIRICIDE | G.D. SEARLE & CO. (US) | 1999-08-31 | — | — | US | disclosed |