Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 8/20 | 0.67 |
| ▸ | LMNA | P02545 | 4/20 | 0.67 |
| ▸ | POLB | P06746 | 3/20 | 0.67 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.61 |
| ▸ | HTT | P42858 | 1/20 | 0.61 |
| ▸ | PKM | P14618 | 1/20 | 0.61 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.60 |
| ▸ | THRB | P10828 | 1/20 | 0.60 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.59 |
| ▸ | TSHR | P16473 | 1/20 | 0.59 |
| ▸ | MAPT | P10636 | 2/20 | 0.57 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.57 |
| ▸ | MEN1 | O00255 | 1/20 | 0.52 |
| ▸ | TP53 | P04637 | 1/20 | 0.51 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL3006633 | 0.93 | ALDH1A1 (0.62) | ALDH1A1LMNAPOLBKMT2AHTT | |
| SCHEMBL3001531 | 0.90 | ALDH1A1 (0.60) | ALDH1A1LMNAPOLBKMT2AHTT | |
| SCHEMBL2995620 | 0.89 | ALDH1A1 (0.57) | ALDH1A1LMNAPOLBKMT2AHTT | |
| SCHEMBL3005532 | 0.89 | ALDH1A1 (0.61) | ALDH1A1LMNAPOLBKMT2AHTT | |
| SCHEMBL3002824 | 0.89 | ALDH1A1 (0.64) | ALDH1A1LMNAPOLBKMT2AHTT | |
| SCHEMBL3005234 | 0.89 | ALDH1A1 (0.66) | ALDH1A1LMNAPOLBKMT2AHTT | |
| SCHEMBL2990880 | 0.89 | ALDH1A1 (0.67) | ALDH1A1LMNAPOLBKMT2AHTT | |
| SCHEMBL4260592 | 0.88 | ALDH1A1 (0.58) | ALDH1A1LMNAPOLBKMT2AHTT | |
| SCHEMBL3002849 | 0.88 | ALDH1A1 (0.64) | ALDH1A1LMNAPOLBKMT2APKM | |
| SCHEMBL3268171 | 0.87 | ALDH1A1 (0.68) | ALDH1A1LMNAPOLBKMT2AHTT |
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 |