Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AAK1 | Q2M2I8 | 11/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | LMNA | P02545 | 2/20 | 0.35 |
| ▸ | MAPT | P10636 | 2/20 | 0.35 |
| ▸ | HTT | P42858 | 2/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.35 |
| ▸ | PKM | P14618 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.35 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.35 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.32 |
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.32 |
| ▸ | ADORA2A | P29274 | 2/20 | 0.32 |
| ▸ | ADORA1 | P30542 | 2/20 | 0.32 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL29857628 | 0.79 | HCAR2 (0.36) | ADORA2AHCAR2 | |
| SCHEMBL20772009 | 0.79 | HCAR2 (0.36) | ADORA2AHCAR2 | |
| SCHEMBL26917030 | 0.79 | HCAR2 (0.36) | ADORA2AHCAR2 | |
| SCHEMBL13995183 | 0.79 | GBA1 (0.36) | AAK1ALDH1A1LMNAMAPTHTT | |
| SCHEMBL29397683 | 0.79 | HCAR2 (0.36) | ADORA2AHCAR2 | |
| SCHEMBL20785235 | 0.79 | HCAR2 (0.36) | ADORA2AHCAR2 | |
| Hydrochloric Acid SCHEMBL21768907 | 0.77 | HCAR2 (0.35) | ADORA2AHCAR2 | |
| Hydrochloric Acid SCHEMBL21768905 | 0.77 | HCAR2 (0.35) | ADORA2AHCAR2 | |
| Hydrochloric Acid SCHEMBL28900190 | 0.77 | HCAR2 (0.35) | ADORA2AHCAR2 | |
| Hydrochloric Acid SCHEMBL28900193 | 0.77 | HCAR2 (0.35) | ADORA2AHCAR2 |
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-2011013644-A1 | SUBSTITUTED PIPERIDINE COMPOUND | 第一三共株式会社 (JP) | 2011-02-03 | — | — | WO | disclosed |