Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TP53 | P04637 | 1/20 | 0.69 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.69 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.69 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.69 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.69 |
| ▸ | TSHR | P16473 | 1/20 | 0.69 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.69 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.69 |
| ▸ | MTOR | P42345 | 1/20 | 0.69 |
| ▸ | RAB9A | P51151 | 1/20 | 0.69 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.69 |
| ▸ | QPCT | Q16769 | 8/20 | 0.67 |
| ▸ | MEN1 | O00255 | 1/20 | 0.67 |
| ▸ | GMNN | O75496 | 1/20 | 0.67 |
| ▸ | LMNA | P02545 | 1/20 | 0.67 |
| ▸ | MAPT | P10636 | 1/20 | 0.67 |
| ▸ | BLM | P54132 | 1/20 | 0.67 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.67 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.67 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.67 |
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 | |
|---|---|---|---|---|
| SCHEMBL5757028 | 0.88 | TSHR (0.58) | TP53CYP1A2CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL5758544 | 0.87 | CYP1A2 (0.58) | TP53CYP1A2CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL19786271 | 0.83 | QPCT (0.58) | TP53CYP1A2CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL19766926 | 0.82 | QPCT (0.59) | TP53CYP1A2CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL12845734 | 0.82 | TP53 (0.60) | TP53CYP1A2CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL10508142 | 0.81 | MEN1 (0.69) | TP53CYP1A2CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL76179 | 0.81 | QPCT (1.00) | QPCTQPCTLALDH1A1 | |
| SCHEMBL5759435 | 0.79 | MAPK1 (0.58) | TP53CYP1A2CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL16350670 | 0.79 | QPCT (0.77) | TSHRQPCTMEN1MAPTKMT2A | |
| SCHEMBL19766927 | 0.79 | QPCT (0.53) | TP53CYP1A2CYP3A4CYP2D6CYP2C9 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2117540-A1 | NEW USE OF GLUTAMINYL CYCLASE INHIBITORS | Probiodrug AG (DE) | 2009-11-18 | — | — | EP | disclosed |
| WO-2008104580-A1 | NEW USE OF GLUTAMINYL CYCLASE INHIBITORS | PROBIODRUG AG (DE) | 2008-09-04 | — | — | WO | disclosed |