Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.55 |
| ▸ | HTT | P42858 | 1/20 | 0.55 |
| ▸ | NCOA1 | Q15788 | 1/20 | 0.55 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.55 |
| ▸ | NCOA3 | Q9Y6Q9 | 1/20 | 0.55 |
| ▸ | CNR2 | P34972 | 1/20 | 0.51 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.51 |
| ▸ | SOAT1 | P35610 | 1/20 | 0.50 |
| ▸ | LDHA | P00338 | 1/20 | 0.50 |
| ▸ | GPR88 | Q9GZN0 | 1/20 | 0.50 |
| ▸ | MMP1 | P03956 | 1/20 | 0.49 |
| ▸ | ATM | Q13315 | 1/20 | 0.49 |
| ▸ | GAA | P10253 | 1/20 | 0.49 |
| ▸ | CRHBP | P24387 | 1/20 | 0.48 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.48 |
| ▸ | EPHX1 | P07099 | 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 | |
|---|---|---|---|---|
| SCHEMBL9054827 | 0.95 | CNR2 (0.58) | ALDH1A1HTTNCOA1SMN1; SMN2NCOA3 | |
| SCHEMBL9053899 | 0.87 | MTNR1A (0.58) | ALDH1A1HTTNCOA1SMN1; SMN2NCOA3 | |
| SCHEMBL8866666 | 0.87 | ALDH1A1 (0.52) | ALDH1A1HTTNCOA1SMN1; SMN2NCOA3 | |
| SCHEMBL6813188 | 0.86 | ALDH1A1 (0.71) | ALDH1A1HTTNCOA1SMN1; SMN2NCOA3 | |
| SCHEMBL16889096 | 0.86 | ALDH1A1 (0.71) | ALDH1A1HTTNCOA1SMN1; SMN2NCOA3 | |
| Hydrochloric Acid SCHEMBL6813768 | 0.84 | ALDH1A1 (0.69) | ALDH1A1HTTNCOA1SMN1; SMN2NCOA3 | |
| SCHEMBL5304216 | 0.83 | ALDH1A1 (0.60) | ALDH1A1HTTNCOA1SMN1; SMN2NCOA3 | |
| Acetic Acid SCHEMBL8866661 | 0.83 | SMN1; SMN2 (0.56) | ALDH1A1HTTNCOA1SMN1; SMN2NCOA3 | |
| SCHEMBL9321544 | 0.80 | ALDH1A1 (0.58) | ALDH1A1HTTNCOA1SMN1; SMN2NCOA3 | |
| SCHEMBL8866907 | 0.80 | ALDH1A1 (0.52) | ALDH1A1HTTNCOA1SMN1; SMN2NCOA3 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0356035-B1 | Arylkalkyl-amines and -amides having anticonvulsant and neuroprotective properties | ASTRA AB (SE) | 1996-03-13 | — | — | EP | claimed |