Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 3/20 | 0.52 |
| ▸ | HTT | P42858 | 1/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 8/20 | 0.50 |
| ▸ | NPSR1 | Q6W5P4 | 3/20 | 0.49 |
| ▸ | THRB | P10828 | 2/20 | 0.49 |
| ▸ | LMNA | P02545 | 3/20 | 0.49 |
| ▸ | MAPT | P10636 | 2/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.47 |
| ▸ | PKM | P14618 | 1/20 | 0.46 |
| ▸ | TP53 | P04637 | 2/20 | 0.45 |
| ▸ | USP2 | O75604 | 1/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL3002828 | 0.90 | ALDH1A1 (0.64) | KMT2AHTTALDH1A1NPSR1THRB | |
| SCHEMBL3248783 | 0.81 | ALDH1A1 (0.64) | KMT2AHTTALDH1A1NPSR1THRB | |
| SCHEMBL2994423 | 0.78 | ALDH1A1 (0.66) | KMT2AHTTALDH1A1NPSR1THRB | |
| SCHEMBL2994174 | 0.78 | ALDH1A1 (0.69) | KMT2AHTTALDH1A1NPSR1THRB | |
| SCHEMBL3247603 | 0.76 | PKM (0.59) | KMT2AHTTALDH1A1NPSR1THRB | |
| SCHEMBL2993618 | 0.76 | ALDH1A1 (0.71) | KMT2AHTTALDH1A1NPSR1THRB | |
| SCHEMBL3001165 | 0.74 | ALDH1A1 (0.56) | KMT2AALDH1A1NPSR1LMNAMAPT | |
| SCHEMBL2997744 | 0.74 | ALDH1A1 (0.54) | KMT2AHTTALDH1A1NPSR1LMNA | |
| SCHEMBL2993979 | 0.74 | ALDH1A1 (0.67) | KMT2AHTTALDH1A1NPSR1LMNA | |
| SCHEMBL3250826 | 0.74 | ALDH1A1 (0.58) | KMT2AHTTALDH1A1NPSR1THRB |
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 |