Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.50 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.48 |
| ▸ | GAA | P10253 | 1/20 | 0.48 |
| ▸ | PKM | P14618 | 1/20 | 0.43 |
| ▸ | GLA | P06280 | 1/20 | 0.42 |
| ▸ | CA1 | P00915 | 1/20 | 0.41 |
| ▸ | CA2 | P00918 | 1/20 | 0.41 |
| ▸ | CA9 | Q16790 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 2/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.39 |
| ▸ | PAOX | Q6QHF9 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL5605675 | 0.77 | EPHX1 (0.49) | ALDH1A1EPHX1GAAPKMGLA | |
| SCHEMBL5605682 | 0.77 | EPHX1 (0.49) | ALDH1A1EPHX1GAAPKMGLA | |
| SCHEMBL3225073 | 0.73 | EPHX1 (0.50) | ALDH1A1EPHX1GAACA1CA2 | |
| SCHEMBL19742394 | 0.72 | SIGMAR1 (0.63) | ALDH1A1EPHX1GAAKMT2ASMN1; SMN2 | |
| SCHEMBL9925862 | 0.70 | SMN1; SMN2 (0.54) | ALDH1A1GAAGLACA1CA2 | |
| SCHEMBL27370024 | 0.70 | EPHX1 (0.47) | ALDH1A1EPHX1GAASMN1; SMN2EPHX2 | |
| SCHEMBL465026 | 0.69 | GLA (0.74) | ALDH1A1GAAGLALMNAKDM4E | |
| SCHEMBL6383968 | 0.69 | HPGD (0.59) | ALDH1A1GAAMEN1KMT2ANPSR1 | |
| SCHEMBL6383966 | 0.69 | HPGD (0.59) | ALDH1A1GAAMEN1KMT2ANPSR1 | |
| SCHEMBL6382316 | 0.69 | HPGD (0.59) | ALDH1A1GAAMEN1KMT2ANPSR1 |
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-1187847-A1 | STREPTOGRAMIN DERIVATIVES, PREPARATION AND COMPOSITIONS CONTAINING THEM | Aventis Pharma S.A. (FR) | 2002-03-20 | — | — | EP | disclosed |
| WO-2001002427-A1 | STREPTOGRAMIN DERIVATIVES, PREPARATION AND COMPOSITIONS CONTAINING THEM | AVENTIS PHARMA S.A. (FR) | 2001-01-11 | — | — | WO | disclosed |