Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LMNA | P02545 | 1/20 | 0.49 |
| ▸ | CYP2D6 | P10635 | 4/20 | 0.46 |
| ▸ | MAOA | P21397 | 1/20 | 0.45 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.45 |
| ▸ | MTNR1A | P48039 | 3/20 | 0.41 |
| ▸ | MTNR1B | P49286 | 3/20 | 0.41 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.41 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.41 |
| ▸ | ADRB3 | P13945 | 1/20 | 0.41 |
| ▸ | SCN4A | P35499 | 2/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | MTOR | P42345 | 1/20 | 0.36 |
| ▸ | TP53 | P04637 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.36 |
| ▸ | SLC22A2 | O15244 | 1/20 | 0.36 |
| ▸ | SLC22A1 | O15245 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL22249309 | 0.84 | KDM4E (0.36) | LMNACYP2D6CYP2C9CYP2C19NPC1 | |
| SCHEMBL22233284 | 0.84 | ALDH1A1 (0.43) | LMNAMAPK1ALDH1A1SMN1; SMN2TSHR | |
| SCHEMBL6490888 | 0.83 | CYP2D6 (0.43) | LMNACYP2D6MAOAPTGS1MTNR1A | |
| SCHEMBL22233863 | 0.80 | CA2 (0.39) | LMNACYP2D6CYP2C9CYP2C19NPC1 | |
| SCHEMBL3603475 | 0.80 | ALDH1A3 (0.42) | LMNACYP2D6ADRB2ADRB1ADRB3 | |
| SCHEMBL1931571 | 0.80 | ALDH1A3 (0.42) | LMNACYP2D6ADRB2ADRB1ADRB3 | |
| SCHEMBL19750656 | 0.80 | LMNA (0.44) | LMNAHSD17B10ALDH1A1 | |
| SCHEMBL817869 | 0.80 | CYP2D6 (0.43) | LMNACYP2D6MAOAPTGS1MTNR1A | |
| SCHEMBL714416 | 0.80 | CYP2D6 (0.43) | LMNACYP2D6MAOAPTGS1MTNR1A | |
| SCHEMBL8429746 | 0.80 | CYP2D6 (0.43) | LMNACYP2D6MAOAPTGS1MTNR1A |
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-2005016885-A2 | COMPOUNDS WITH COMBINED CALCIUM CHANNEL BLOCKER AND β-ADRENERGIC ANTAGONIST OR PARTIAL AGONIST ACTIVITIES FOR TREATMENT OF HEART DISEASE | ARTESIAN THERAPEUTICS, INC. (US) | 2005-02-24 | — | — | WO | disclosed |