Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.49 |
| ▸ | HTT | P42858 | 2/20 | 0.49 |
| ▸ | GAA | P10253 | 1/20 | 0.49 |
| ▸ | MAPT | P10636 | 1/20 | 0.49 |
| ▸ | PKM | P14618 | 1/20 | 0.49 |
| ▸ | USP2 | O75604 | 1/20 | 0.47 |
| ▸ | TSHR | P16473 | 1/20 | 0.47 |
| ▸ | LDHA | P00338 | 1/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 2/20 | 0.40 |
| ▸ | CYP17A1 | P05093 | 1/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.39 |
| ▸ | NR1D1 | P20393 | 1/20 | 0.39 |
| ▸ | BMP1 | P13497 | 1/20 | 0.39 |
| ▸ | PPARG | P37231 | 1/20 | 0.39 |
| ▸ | PPARA | Q07869 | 1/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | ACHE | P22303 | 1/20 | 0.38 |
| ▸ | YAP1 | P46937 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL30528327 | 0.88 | ALDH1A1 (0.45) | ALDH1A1SMN1; SMN2HTTGAAMAPT | |
| SCHEMBL11579749 | 0.80 | LDHA (0.43) | ALDH1A1SMN1; SMN2HTTUSP2TSHR | |
| SCHEMBL10519344 | 0.80 | LDHA (0.43) | ALDH1A1SMN1; SMN2HTTUSP2TSHR | |
| SCHEMBL11400130 | 0.80 | LDHA (0.43) | ALDH1A1SMN1; SMN2HTTUSP2TSHR | |
| SCHEMBL16991848 | 0.79 | ALDH1A1 (0.42) | ALDH1A1SMN1; SMN2HTTGAAMAPT | |
| SCHEMBL8893537 | 0.79 | LDHA (0.44) | ALDH1A1SMN1; SMN2HTTLDHATDP1 | |
| SCHEMBL11148899 | 0.78 | LDHA (0.43) | ALDH1A1SMN1; SMN2HTTGAAMAPT | |
| SCHEMBL5494081 | 0.78 | LDHA (0.43) | ALDH1A1SMN1; SMN2HTTLDHATDP1 | |
| SCHEMBL24291657 | 0.77 | ALDH1A1 (0.43) | ALDH1A1SMN1; SMN2HTTLDHATDP1 | |
| SCHEMBL18204035 | 0.76 | ALDH1A1 (0.41) | ALDH1A1SMN1; SMN2TDP1LMNAL3MBTL1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3102200-A2 | THERAPEUTIC COMPOUNDS AND COMPOSITIONS | Exithera Pharmaceuticals Inc. (US) | 2016-12-14 | — | — | EP | disclosed |
| WO-2015120062-A2 | THERAPEUTIC COMPOUNDS AND COMPOSITIONS | eXIthera Pharmaceuticals Inc. (US) | 2015-08-13 | — | — | WO | disclosed |