Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.58 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.54 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.54 |
| ▸ | TSHR | P16473 | 1/20 | 0.53 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.52 |
| ▸ | POLB | P06746 | 1/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.48 |
| ▸ | MAPT | P10636 | 3/20 | 0.47 |
| ▸ | PLA2G1B | P04054 | 1/20 | 0.47 |
| ▸ | ATG4B | Q9Y4P1 | 1/20 | 0.47 |
| ▸ | GAA | P10253 | 1/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.47 |
| ▸ | HPGD | P15428 | 2/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.47 |
| ▸ | MEN1 | O00255 | 1/20 | 0.46 |
| ▸ | PKM | P14618 | 1/20 | 0.46 |
| ▸ | NPC1 | O15118 | 1/20 | 0.46 |
| ▸ | RAB9A | P51151 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL7514141 | 0.85 | ALDH1A1 (0.54) | ALDH1A1MAPK1TSHRSMN1; SMN2POLB | |
| SCHEMBL2079317 | 0.85 | ALDH1A1 (0.54) | ALDH1A1MAPK1TSHRSMN1; SMN2POLB | |
| SCHEMBL2080107 | 0.83 | ALDH1A1 (0.52) | ALDH1A1MAPK1TSHRSMN1; SMN2POLB | |
| SCHEMBL10715141 | 0.81 | ALDH1A1 (0.50) | ALDH1A1MAPK1TSHRSMN1; SMN2POLB | |
| SCHEMBL79163 | 0.81 | DTYMK (0.62) | ALDH1A1MAPK1TSHRSMN1; SMN2POLB | |
| SCHEMBL40329 | 0.81 | ALDH1A1 (0.59) | ALDH1A1MAPK1TSHRSMN1; SMN2POLB | |
| SCHEMBL20556400 | 0.80 | ALDH1A1 (0.53) | ALDH1A1MAPK1TSHRSMN1; SMN2POLB | |
| SCHEMBL339922 | 0.79 | ALDH1A1 (0.57) | ALDH1A1MAPK1TSHRSMN1; SMN2POLB | |
| SCHEMBL6395556 | 0.79 | ALDH1A1 (0.57) | ALDH1A1MAPK1TSHRSMN1; SMN2POLB | |
| Hydrochloric Acid SCHEMBL1138798 | 0.79 | DTYMK (0.60) | ALDH1A1MAPK1TSHRSMN1; SMN2POLB |
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 |
|---|---|---|---|---|---|---|---|
| WO-2011114160-A1 | ANAGRELIDE DERIVATIVES (IMIDAZO [2, 1-B] QUINAZOLIN - 2 - ONES ) AS PDE III INHIBITORS USEFUL AS ANTITHROMBOTIC AGENTS | SHIRE LLC (US) | 2011-09-22 | — | — | WO | disclosed |