Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIRT2 | Q8IXJ6 | 1/20 | 0.44 |
| ▸ | RAB9A | P51151 | 5/20 | 0.37 |
| ▸ | NPC1 | O15118 | 2/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | TSHR | P16473 | 2/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.37 |
| ▸ | MAPT | P10636 | 2/20 | 0.36 |
| ▸ | APLNR | P35414 | 1/20 | 0.35 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.35 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.35 |
| ▸ | KIF11 | P52732 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL4214065 | 1.00 | SIRT2 (0.44) | SIRT2RAB9ANPC1ALDH1A1TSHR | |
| Hydrochloric Acid SCHEMBL27729421 | 0.99 | SIRT2 (0.43) | SIRT2RAB9ANPC1ALDH1A1TSHR | |
| Hydrochloric Acid SCHEMBL4219539 | 0.99 | SIRT2 (0.43) | SIRT2RAB9ANPC1ALDH1A1TSHR | |
| SCHEMBL8168327 | 0.84 | ESR1 (0.49) | ALDH1A1KIF11 | |
| SCHEMBL17203107 | 0.82 | ADORA2A (0.40) | ALDH1A1TSHRAPLNRKIF11 | |
| SCHEMBL20397637 | 0.82 | KIF11 (0.46) | ALDH1A1KIF11 | |
| SCHEMBL4208145 | 0.81 | CYP1A2 (0.47) | RAB9ANPC1ALDH1A1TSHRKDM4E | |
| SCHEMBL25869512 | 0.81 | ALDH1A1 (0.41) | SIRT2RAB9ANPC1ALDH1A1TSHR | |
| SCHEMBL19361279 | 0.81 | ALDH1A1 (0.41) | ALDH1A1KIF11 | |
| SCHEMBL29952877 | 0.81 | ALDH1A1 (0.38) | ALDH1A1KDM4EKIF11 |
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-101360736-A | L-alanine derivatives | ASTRAZENECA AB (SE) | 2009-02-04 | — | — | CN | disclosed |