Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 9/20 | 0.64 |
| ▸ | LMNA | P02545 | 4/20 | 0.64 |
| ▸ | PKM | P14618 | 1/20 | 0.60 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.57 |
| ▸ | HTT | P42858 | 1/20 | 0.57 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.54 |
| ▸ | THRB | P10828 | 1/20 | 0.54 |
| ▸ | MAPT | P10636 | 3/20 | 0.54 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.54 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.48 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.48 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.48 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.48 |
| ▸ | TSHR | P16473 | 1/20 | 0.48 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.47 |
| ▸ | TP53 | P04637 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL2993618 | 0.95 | ALDH1A1 (0.71) | ALDH1A1LMNAPKMKMT2AHTT | |
| SCHEMBL2994174 | 0.93 | ALDH1A1 (0.69) | ALDH1A1LMNAPKMKMT2AHTT | |
| SCHEMBL3247603 | 0.91 | PKM (0.59) | ALDH1A1LMNAPKMKMT2AHTT | |
| SCHEMBL3126934 | 0.88 | ALDH1A1 (0.59) | ALDH1A1LMNAPKMKMT2AHTT | |
| SCHEMBL2999575 | 0.85 | PKM (0.64) | ALDH1A1LMNAPKMKMT2AHTT | |
| SCHEMBL2994188 | 0.85 | PKM (0.66) | ALDH1A1LMNAPKMKMT2AHTT | |
| SCHEMBL3005944 | 0.84 | ALDH1A1 (0.67) | ALDH1A1LMNAPKMKMT2AHTT | |
| SCHEMBL3006560 | 0.83 | ALDH1A1 (0.66) | ALDH1A1LMNAPKMKMT2AHTT | |
| SCHEMBL3005234 | 0.82 | ALDH1A1 (0.66) | ALDH1A1LMNAPKMKMT2AHTT | |
| SCHEMBL3002828 | 0.82 | ALDH1A1 (0.64) | ALDH1A1LMNAPKMKMT2AHTT |
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 |