Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE | P22303 | 1/20 | 0.62 |
| ▸ | BACE1 | P56817 | 1/20 | 0.62 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.53 |
| ▸ | POLB | P06746 | 1/20 | 0.53 |
| ▸ | NPC1 | O15118 | 1/20 | 0.53 |
| ▸ | PKM | P14618 | 1/20 | 0.53 |
| ▸ | RAB9A | P51151 | 1/20 | 0.53 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.53 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.53 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.53 |
| ▸ | TP53 | P04637 | 2/20 | 0.52 |
| ▸ | ERCC1 | P07992 | 2/20 | 0.52 |
| ▸ | ERCC4 | Q92889 | 2/20 | 0.52 |
| ▸ | TRPV1 | Q8NER1 | 3/20 | 0.52 |
| ▸ | TSHR | P16473 | 1/20 | 0.51 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL11981523 | 0.91 | ACHE (0.66) | ACHEBACE1ALDH1A1POLBNPC1 | |
| SCHEMBL42690 | 0.89 | ACHE (0.56) | ACHEBACE1ALDH1A1POLBNPC1 | |
| SCHEMBL42652 | 0.89 | ACHE (0.56) | ACHEBACE1ALDH1A1POLBNPC1 | |
| SCHEMBL38771 | 0.88 | TRPV1 (0.53) | ACHEBACE1ALDH1A1POLBNPC1 | |
| SCHEMBL42093 | 0.88 | ACHE (0.55) | ACHEBACE1ALDH1A1POLBNPC1 | |
| SCHEMBL42409 | 0.88 | TP53 (0.55) | ACHEBACE1ALDH1A1POLBNPC1 | |
| SCHEMBL42828 | 0.88 | TP53 (0.55) | ACHEBACE1ALDH1A1POLBNPC1 | |
| SCHEMBL42408 | 0.88 | TP53 (0.55) | ACHEBACE1ALDH1A1POLBNPC1 | |
| SCHEMBL43303 | 0.87 | ACHE (0.54) | ACHEBACE1ALDH1A1POLBNPC1 | |
| SCHEMBL47228 | 0.87 | ACHE (0.54) | ACHEBACE1ALDH1A1POLBNPC1 |
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-2009136625-A1 | CYCLIC AMINE-1-CARBOXYLIC ACID ESTER DERIVATIVE AND PHARMACEUTICAL COMPOSITION CONTAINING THE SAME | 大日本住友製薬株式会社 (JP) | 2009-11-12 | — | — | WO | disclosed |