Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GSTA1 | P08263 | 3/20 | 0.55 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.51 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.51 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.51 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.51 |
| ▸ | CES2 | O00748 | 1/20 | 0.50 |
| ▸ | GALR3 | O60755 | 1/20 | 0.50 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.50 |
| ▸ | HPGD | P15428 | 1/20 | 0.50 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.50 |
| ▸ | CASP1 | P29466 | 1/20 | 0.50 |
| ▸ | MEN1 | O00255 | 4/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.45 |
| ▸ | NPC1 | O15118 | 3/20 | 0.45 |
| ▸ | RAB9A | P51151 | 2/20 | 0.45 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.45 |
| ▸ | AR | P10275 | 4/20 | 0.44 |
| ▸ | ESR1 | P03372 | 1/20 | 0.43 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 2/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL11121902 | 0.81 | CYP2C9 (0.53) | GSTA1CYP2C9CYP2C19CYP3A4NPSR1 | |
| SCHEMBL11117678 | 0.81 | HSPD1 (0.48) | CYP2C9CYP2C19CYP3A4NPSR1CYP1A2 | |
| SCHEMBL777261 | 0.80 | NPC1 (0.53) | HPGDMEN1KMT2ANPC1RAB9A | |
| SCHEMBL29436920 | 0.80 | NPC1 (0.53) | HPGDMEN1KMT2ANPC1RAB9A | |
| SCHEMBL25028 | 0.79 | HPGD (0.58) | GSTA1CYP2C9CYP2C19CES2GALR3 | |
| SCHEMBL11121871 | 0.79 | MAOA (0.52) | GSTA1CYP2C9CYP2C19CES2GALR3 | |
| SCHEMBL11115932 | 0.78 | NPC1 (0.50) | GSTA1CYP2C9CYP2C19NPSR1CES2 | |
| SCHEMBL205635 | 0.75 | CA12 (0.67) | GSTA1CYP2C9CYP2C19CES2GALR3 | |
| SCHEMBL30362168 | 0.75 | CA12 (0.67) | GSTA1CYP2C9CYP2C19CES2GALR3 | |
| SCHEMBL31083917 | 0.74 | CA12 (0.70) | GSTA1CYP2C9CYP2C19CES2GALR3 |
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-4444844-A | LEUCO DYE, SPECIFIC PHENYL BENZOATES AS DEVELOPER AND PROMOTER, FOR HIGH SPEED AND DENSITY | RICOH CO., LTD. (JP) | 1984-04-24 | — | — | US | disclosed |