Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 9/20 | 0.45 |
| ▸ | LMNA | P02545 | 5/20 | 0.45 |
| ▸ | POLB | P06746 | 2/20 | 0.45 |
| ▸ | USP2 | O75604 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 2/20 | 0.37 |
| ▸ | PTGES | O14684 | 1/20 | 0.37 |
| ▸ | PKM | P14618 | 1/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.36 |
| ▸ | MAPT | P10636 | 2/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | GPBAR1 | Q8TDU6 | 1/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | THRB | P10828 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL3000579 | 0.86 | ALDH1A1 (0.58) | ALDH1A1LMNAPOLBUSP2GAA | |
| SCHEMBL3003775 | 0.86 | ALDH1A1 (0.56) | ALDH1A1LMNAPOLBTSHRPTGES | |
| SCHEMBL2995701 | 0.79 | ALDH1A1 (0.59) | ALDH1A1LMNAPOLBTSHRPKM | |
| SCHEMBL3000568 | 0.76 | ALDH1A1 (0.60) | ALDH1A1LMNAPOLBTSHRPTGES | |
| SCHEMBL3001260 | 0.75 | ALDH1A1 (0.57) | ALDH1A1LMNAPOLBTSHRPKM | |
| SCHEMBL2999584 | 0.75 | ALDH1A1 (0.57) | ALDH1A1LMNAPOLBTSHRPKM | |
| SCHEMBL3001406 | 0.75 | ALDH1A1 (0.57) | ALDH1A1LMNAPOLBTSHRPKM | |
| SCHEMBL3003433 | 0.75 | ALDH1A1 (0.57) | ALDH1A1LMNAPOLBTSHRPKM | |
| SCHEMBL3246754 | 0.74 | ALDH1A1 (0.60) | ALDH1A1LMNAPOLBUSP2GAA | |
| SCHEMBL3000593 | 0.73 | ALDH1A1 (0.57) | ALDH1A1LMNAPOLBUSP2GAA |
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-2010002483-A1 | OPTIONALLY CONDENSED DIHYDRO PYRIDINE, DIHYDROPYRIMIDINE AND DIHYDRO PYRANE DERIVATIVES ACTING AS LATE SODIUM CHANNEL BLOCKERS | CV THERAPEUTICS, INC. (US) | 2010-01-07 | — | — | WO | disclosed |