Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.36 |
| ▸ | PDK1 | Q15118 | 1/20 | 0.34 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | RIPK1 | Q13546 | 1/20 | 0.31 |
| ▸ | NPC1 | O15118 | 2/20 | 0.31 |
| ▸ | RAB9A | P51151 | 1/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL29393471 | 0.84 | — | — | |
| SCHEMBL12820 | 0.84 | — | — | |
| Hydrochloric Acid SCHEMBL28163755 | 0.82 | ALDH1A1 (0.46) | ALDH1A1HSD17B10PDK1POLBRIPK1 | |
| Pyrrole SCHEMBL28787213 | 0.81 | ALDH1A1 (0.39) | ALDH1A1HSD17B10PDK1POLBRIPK1 | |
| SCHEMBL28733170 | 0.79 | ALDH1A1 (0.35) | ALDH1A1HSD17B10PDK1RIPK1 | |
| Benzo[D]Thiazole SCHEMBL360258 | 0.78 | ALDH1A1 (0.66) | ALDH1A1HSD17B10RIPK1NPC1RAB9A | |
| SCHEMBL518747 | 0.74 | ALDH1A1 (0.39) | ALDH1A1HSD17B10PDK1POLBNPC1 | |
| Piperidine SCHEMBL3628735 | 0.73 | ALDH1A1 (0.36) | ALDH1A1HSD17B10PDK1RIPK1 | |
| Quinoline SCHEMBL2027950 | 0.72 | ALDH1A1 (0.65) | ALDH1A1HSD17B10POLBNPC1RAB9A | |
| Quinoline SCHEMBL28561469 | 0.70 | ALDH1A1 (0.63) | ALDH1A1HSD17B10POLBNPC1RAB9A |
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 |
|---|---|---|---|---|---|---|---|
| WO-2012007510-A1 | COMPOUNDS FOR BINDING AND IMAGING AMYLOID PLAQUES AND THEIR USE | BAYER PHARMA AKTIENGESELLSCHAFT (DE) | 2012-01-19 | — | — | WO | disclosed |
| WO-2012007510-A1 | COMPOUNDS FOR BINDING AND IMAGING AMYLOID PLAQUES AND THEIR USE | BAYER PHARMA AKTIENGESELLSCHAFT (DE) | 2012-01-19 | — | — | WO | disclosed |