Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | THRB | P10828 | 1/20 | 0.56 |
| ▸ | NPC1 | O15118 | 4/20 | 0.51 |
| ▸ | RAB9A | P51151 | 3/20 | 0.51 |
| ▸ | TSHR | P16473 | 1/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.50 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.50 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.50 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.50 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.50 |
| ▸ | HPGD | P15428 | 1/20 | 0.50 |
| ▸ | AGTR1 | P30556 | 1/20 | 0.50 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.50 |
| ▸ | MEN1 | O00255 | 3/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.49 |
| ▸ | GAA | P10253 | 1/20 | 0.49 |
| ▸ | MAPT | P10636 | 1/20 | 0.49 |
| ▸ | KCNMA1 | Q12791 | 1/20 | 0.49 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL14212112 | 0.90 | ALDH1A1 (0.62) | THRBNPC1RAB9ATSHRALDH1A1 | |
| SCHEMBL23014252 | 0.80 | TSHR (0.64) | THRBNPC1RAB9ATSHRALDH1A1 | |
| SCHEMBL21391314 | 0.78 | THRB (0.63) | THRBNPC1RAB9ATSHRCYP1A2 | |
| SCHEMBL2817973 | 0.75 | THRB (0.59) | THRBRAB9AALDH1A1KMT2AGAA | |
| SCHEMBL21378834 | 0.73 | MAPT (0.65) | THRBALDH1A1CYP2C9CYP2C19MEN1 | |
| SCHEMBL3864600 | 0.73 | THRB (0.75) | THRBNPC1RAB9ATSHRCYP1A2 | |
| Nicotinuric Acid SCHEMBL30183567 | 0.73 | THRB (0.75) | THRBNPC1RAB9ATSHRALDH1A1 | |
| Nicotinuric Acid SCHEMBL351962 | 0.73 | THRB (0.75) | THRBNPC1RAB9ATSHRALDH1A1 | |
| N-Hydroxymethylnicotinamide SCHEMBL352358 | 0.73 | THRB (1.00) | THRBNPC1RAB9ATSHRALDH1A1 | |
| SCHEMBL4869581 | 0.72 | THRB (0.68) | THRBNPC1RAB9ATSHRALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1534680-B1 | PRENYLATION INHIBITORS AND METHODS OF THEIR SYNTHESIS AND USE | PHARMACO INVESTMENTS INC (US) | 2012-02-22 | — | — | EP | disclosed |