Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH5A1 | P51649 | 1/20 | 0.36 |
| ▸ | ABAT | P80404 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.33 |
| ▸ | SCN10A | Q9Y5Y9 | 1/20 | 0.33 |
| ▸ | CYP2A6 | P11509 | 2/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.32 |
| ▸ | EGFR | P00533 | 1/20 | 0.31 |
| ▸ | TRIM24 | O15164 | 1/20 | 0.31 |
| ▸ | TRIM33 | Q9UPN9 | 1/20 | 0.31 |
| ▸ | CDC7 | O00311 | 1/20 | 0.30 |
| ▸ | PIM1 | P11309 | 1/20 | 0.30 |
| ▸ | CSNK2B | P67870 | 1/20 | 0.30 |
| ▸ | CSNK2A1 | P68400 | 1/20 | 0.30 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL8046771 | 1.00 | ALDH5A1 (0.36) | ALDH5A1ABATALDH1A1KDM4ESCN10A | |
| SCHEMBL6614019 | 0.79 | S1PR4 (0.41) | ALDH5A1ABATALDH1A1KDM4ECYP2A6 | |
| SCHEMBL27603362 | 0.77 | SCN10A (0.35) | ALDH1A1SCN10AHSD17B10 | |
| SCHEMBL4685465 | 0.77 | CDC7 (0.40) | ALDH1A1SCN10ACDC7PIM1CSNK2B | |
| SCHEMBL1665524 | 0.76 | TSHR (0.41) | ALDH1A1SMN1; SMN2 | |
| SCHEMBL5739415 | 0.76 | GBA1 (0.46) | SCN10ACYP2A6HSD17B10 | |
| SCHEMBL6142909 | 0.76 | GBA1 (0.46) | SCN10ACYP2A6HSD17B10 | |
| SCHEMBL17967133 | 0.74 | ALDH1A1 (0.41) | ALDH1A1CYP2A6 | |
| SCHEMBL8565971 | 0.73 | SCN10A (0.38) | ALDH1A1SCN10AHSD17B10CDC7PIM1 | |
| SCHEMBL13801056 | 0.72 | KDM1A (0.44) | ALDH1A1 |
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-2000032605-A1 | BI-PYRROLIDINYLVINL (CARBA) CEPHALOSPORINS | F. HOFFMANN-LA ROCHE AG (CH) | 2000-06-08 | — | — | WO | disclosed |