Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAB9A | P51151 | 4/20 | 0.58 |
| ▸ | POLB | P06746 | 2/20 | 0.55 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.55 |
| ▸ | BACE1 | P56817 | 1/20 | 0.55 |
| ▸ | LMNA | P02545 | 3/20 | 0.54 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.54 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.53 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.52 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.52 |
| ▸ | NPC1 | O15118 | 3/20 | 0.52 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.52 |
| ▸ | TP53 | P04637 | 2/20 | 0.52 |
| ▸ | PKM | P14618 | 1/20 | 0.52 |
| ▸ | MAPT | P10636 | 2/20 | 0.52 |
| ▸ | TSHR | P16473 | 1/20 | 0.52 |
| ▸ | GAA | P10253 | 1/20 | 0.52 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.52 |
| ▸ | NAMPT | P43490 | 2/20 | 0.51 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.51 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL20852322 | 0.86 | NPC1 (0.56) | RAB9APOLBBACE1ALDH1A1KDM4E | |
| SCHEMBL791143 | 0.81 | RAB9A (0.69) | RAB9APOLBKMT2ALMNAALDH1A1 | |
| SCHEMBL17850187 | 0.79 | BACE1 (0.56) | BACE1SMN1; SMN2 | |
| SCHEMBL2228108 | 0.78 | RAB9A (0.65) | RAB9APOLBKMT2ALMNAALDH1A1 | |
| SCHEMBL17169010 | 0.78 | NPC1 (0.68) | RAB9ABACE1LMNAALDH1A1NPC1 | |
| SCHEMBL10193569 | 0.76 | BACE1 (0.67) | BACE1 | |
| SCHEMBL14339876 | 0.76 | SMN1; SMN2 (0.64) | RAB9APOLBKMT2ALMNAALDH1A1 | |
| SCHEMBL12707716 | 0.76 | LMNA (0.73) | RAB9APOLBLMNAALDH1A1HIF1A | |
| SCHEMBL12469188 | 0.75 | ATG4B (0.69) | RAB9AKMT2ALMNAALDH1A1HSD17B10 | |
| SCHEMBL21595592 | 0.75 | TSHR (0.69) | RAB9APOLBKMT2AALDH1A1KDM4E |
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 |
|---|---|---|---|---|---|---|---|
| CN-106795177-B | BACE1 inhibitors | 豪夫迈·罗氏有限公司 | 2019-04-23 | — | — | CN | disclosed |