Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE | P22303 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.34 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.30 |
| ▸ | LMNA | P02545 | 1/20 | 0.30 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.30 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.30 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.30 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.30 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.30 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.30 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.30 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.30 |
| ▸ | TSHR | P16473 | 1/20 | 0.30 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.30 |
| ▸ | DRD1 | P21728 | 1/20 | 0.30 |
| ▸ | HRH2 | P25021 | 1/20 | 0.30 |
| ▸ | HTR2A | P28223 | 1/20 | 0.30 |
| ▸ | HTR2C | P28335 | 1/20 | 0.30 |
| ▸ | HRH1 | P35367 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL20798278 | 0.82 | ACHE (0.49) | ACHEMAPK1ABCB11LMNACYP1A2 | |
| SCHEMBL30443547 | 0.82 | ACHE (0.49) | ACHEMAPK1ABCB11LMNACYP1A2 | |
| SCHEMBL6738457 | 0.81 | MAPT (0.48) | MAPTMAPK1 | |
| Cyclohexane SCHEMBL14937783 | 0.71 | MEN1 (0.36) | CYP2C9KMT2A | |
| SCHEMBL121180 | 0.69 | MEN1 (0.39) | CYP2C9KMT2A | |
| SCHEMBL7869696 | 0.69 | MEN1 (0.39) | CYP2C9KMT2A | |
| SCHEMBL12494228 | 0.68 | MEN1 (0.36) | CYP2C9KMT2A | |
| SCHEMBL5599016 | 0.67 | MEN1 (0.38) | CYP2C9KMT2A | |
| Ethylene SCHEMBL14661144 | 0.66 | MEN1 (0.37) | CYP2C9KMT2A | |
| Ethylene SCHEMBL1505696 | 0.66 | MEN1 (0.37) | CYP2C9KMT2A |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3697779-A1 | DANTROLENE PRODRUGS AND METHODS OF THEIR USE | EAGLE RESEARCH LABS LIMITED (MT) | 2020-08-26 | — | — | EP | disclosed |
| WO-2019079721-A1 | DANTROLENE PRODRUGS AND METHODS OF THEIR USE | EAGLE PHARMACEUTICALS, INC. (US) | 2019-04-25 | — | — | WO | disclosed |