Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | GABRR1 | P24046 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | APEX1 | P27695 | 1/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | PPARG | P37231 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.34 |
| ▸ | PTGDR2 | Q9Y5Y4 | 2/20 | 0.33 |
| ▸ | AGBL2 | Q5U5Z8 | 2/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.32 |
| ▸ | ADORA2A | P29274 | 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 | |
|---|---|---|---|---|
| SCHEMBL27386857 | 0.78 | ALDH1A1 (0.38) | ALDH1A1HPGDMEN1KMT2AGAA | |
| SCHEMBL855931 | 0.77 | SLC6A3 (0.41) | ALDH1A1GABRR1MEN1KMT2AGAA | |
| SCHEMBL27514469 | 0.77 | HTT (0.37) | ALDH1A1HPGDPPARGKDM4EHTT | |
| SCHEMBL4093001 | 0.76 | GABRR1 (0.39) | ALDH1A1GABRR1MEN1KMT2AGAA | |
| SCHEMBL9865321 | 0.74 | GABRR1 (0.38) | ALDH1A1GABRR1MEN1KMT2AAPEX1 | |
| SCHEMBL9865312 | 0.74 | GABRR1 (0.38) | ALDH1A1GABRR1MEN1KMT2AAPEX1 | |
| SCHEMBL341456 | 0.74 | GABRR1 (0.42) | ALDH1A1GABRR1APEX1GAAKDM4E | |
| SCHEMBL1417449 | 0.74 | NOS1 (0.43) | ALDH1A1HPGDGABRR1MEN1KMT2A | |
| SCHEMBL8408134 | 0.73 | HTT (0.30) | HTT | |
| SCHEMBL9864687 | 0.73 | GABRR1 (0.37) | ALDH1A1GABRR1MEN1KMT2AAPEX1 |
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-2008016811-A2 | AMINOPIPERIDINES AND REALTED COMPOUNDS | NEUROGEN CORPORATION (US) | 2008-02-07 | — | — | WO | disclosed |