Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 2/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.43 |
| ▸ | RAD52 | P43351 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | CASP3 | P42574 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | SENP8 | Q96LD8 | 1/20 | 0.33 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.33 |
| ▸ | SENP6 | Q9GZR1 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | NPY1R | P25929 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL8082698 | 0.99 | CYP1A2 (0.42) | CYP1A2CYP2D6RAD52ALDH1A1MEN1 | |
| SCHEMBL31561735 | 0.83 | LMNA (0.37) | CYP1A2CYP2D6MEN1NPC1CYP3A4 | |
| SCHEMBL7352827 | 0.79 | PPARG (0.33) | ALDH1A1 | |
| SCHEMBL8083133 | 0.77 | CYP2D6 (0.44) | CYP1A2CYP2D6RAD52ALDH1A1MEN1 | |
| SCHEMBL8506017 | 0.76 | HTR2A (0.36) | CYP1A2CYP2D6MEN1NPC1CYP3A4 | |
| SCHEMBL16844552 | 0.74 | CYP1A2 (0.36) | CYP1A2CYP2D6MEN1NPC1CYP3A4 | |
| SCHEMBL16855175 | 0.74 | CYP1A2 (0.36) | CYP1A2CYP2D6MEN1NPC1CYP3A4 | |
| SCHEMBL30701213 | 0.74 | CYP1A2 (0.36) | CYP1A2CYP2D6MEN1NPC1CYP3A4 | |
| SCHEMBL8402802 | 0.74 | MEN1 (0.35) | CYP1A2CYP2D6MEN1NPC1CYP3A4 | |
| SCHEMBL8406962 | 0.73 | MEN1 (0.33) | CYP1A2CYP2D6MEN1NPC1CYP3A4 |
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-6063810-A | ENANTIOMORPHS | SYNTHELABO (FR) | 2000-05-16 | — | — | US | disclosed |