Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.57 |
| ▸ | HPGD | P15428 | 3/20 | 0.57 |
| ▸ | HTT | P42858 | 1/20 | 0.57 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.57 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.53 |
| ▸ | S1PR4 | O95977 | 4/20 | 0.49 |
| ▸ | ERN1 | O75460 | 2/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.43 |
| ▸ | PKM | P14618 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 2/20 | 0.40 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.40 |
| ▸ | FDPS | P14324 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL30933896 | 0.92 | ALDH1A1 (0.49) | ALDH1A1HPGDHTTSMN1; SMN2TDP1 | |
| SCHEMBL3329518 | 0.85 | HPGD (0.51) | ALDH1A1HPGDSMN1; SMN2TDP1ERN1 | |
| SCHEMBL18570397 | 0.84 | APP (0.49) | ALDH1A1HPGDHTTSMN1; SMN2TDP1 | |
| SCHEMBL18641925 | 0.84 | SMN1; SMN2 (0.49) | ALDH1A1HPGDHTTSMN1; SMN2TDP1 | |
| SCHEMBL20182409 | 0.83 | MAPT (0.45) | ALDH1A1HPGDHTTSMN1; SMN2TDP1 | |
| SCHEMBL20182410 | 0.83 | MAPT (0.48) | ALDH1A1HPGDSMN1; SMN2TDP1KDM4E | |
| SCHEMBL31164711 | 0.82 | TDP1 (0.47) | ALDH1A1HPGDHTTSMN1; SMN2TDP1 | |
| SCHEMBL20535668 | 0.82 | TACR2 (0.54) | ALDH1A1HPGDHTTSMN1; SMN2TDP1 | |
| SCHEMBL2523798 | 0.82 | GAA (0.55) | ALDH1A1HPGDHTTSMN1; SMN2TDP1 | |
| SCHEMBL22090726 | 0.82 | ALDH1A1 (0.45) | ALDH1A1SMN1; SMN2TDP1KDM4EPKM |
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-1081131-A1 | SELECTIVE ANTI-MYCOBACTERIAL PREPARATIONS, METHOD FOR PRODUCING THE SAME AND PHARMACEUTICAL COMPOSITIONS | Institut Organicheskogo Sinteza Uralskogo Otdeleniya Rossiiskoi Akademii Nauck (RU) | 2001-03-07 | — | — | EP | disclosed |