Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 9/20 | 0.58 |
| ▸ | LMNA | P02545 | 3/20 | 0.56 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.53 |
| ▸ | TP53 | P04637 | 2/20 | 0.53 |
| ▸ | MAPT | P10636 | 2/20 | 0.53 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.53 |
| ▸ | HTT | P42858 | 1/20 | 0.53 |
| ▸ | GAA | P10253 | 1/20 | 0.52 |
| ▸ | THRB | P10828 | 1/20 | 0.52 |
| ▸ | NPSR1 | Q6W5P4 | 3/20 | 0.51 |
| ▸ | PKM | P14618 | 1/20 | 0.50 |
| ▸ | POLB | P06746 | 2/20 | 0.48 |
| ▸ | USP2 | O75604 | 1/20 | 0.48 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.48 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.48 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL4263306 | 0.87 | ALDH1A1 (0.77) | ALDH1A1LMNASMN1; SMN2TP53MAPT | |
| SCHEMBL4257057 | 0.85 | ALDH1A1 (0.77) | ALDH1A1LMNASMN1; SMN2MAPTKMT2A | |
| SCHEMBL3243875 | 0.80 | MAPT (0.63) | ALDH1A1LMNASMN1; SMN2TP53MAPT | |
| SCHEMBL2999799 | 0.80 | ALDH1A1 (0.53) | ALDH1A1LMNASMN1; SMN2TP53MAPT | |
| SCHEMBL3003897 | 0.79 | ALDH1A1 (0.52) | ALDH1A1LMNASMN1; SMN2TP53MAPT | |
| SCHEMBL3010244 | 0.79 | THRB (0.54) | ALDH1A1LMNASMN1; SMN2TP53MAPT | |
| SCHEMBL3004302 | 0.79 | KMT2A (0.52) | ALDH1A1LMNASMN1; SMN2TP53MAPT | |
| SCHEMBL4258306 | 0.79 | ALDH1A1 (0.51) | ALDH1A1LMNASMN1; SMN2TP53MAPT | |
| Hydrochloric Acid SCHEMBL3002810 | 0.79 | ALDH1A1 (0.51) | ALDH1A1LMNASMN1; SMN2TP53MAPT | |
| SCHEMBL2992365 | 0.79 | ALDH1A1 (0.51) | ALDH1A1LMNASMN1; SMN2TP53MAPT |
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 |