Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNH2 | Q12809 | 6/20 | 0.61 |
| ▸ | CACNA1F | O60840 | 1/20 | 0.61 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.61 |
| ▸ | ACHE | P22303 | 1/20 | 0.61 |
| ▸ | AGTR1 | P30556 | 1/20 | 0.61 |
| ▸ | DRD3 | P35462 | 1/20 | 0.61 |
| ▸ | CACNA1D | Q01668 | 1/20 | 0.61 |
| ▸ | CACNA1S | Q13698 | 1/20 | 0.61 |
| ▸ | CACNA1C | Q13936 | 1/20 | 0.61 |
| ▸ | NPC1 | O15118 | 2/20 | 0.56 |
| ▸ | RAB9A | P51151 | 2/20 | 0.56 |
| ▸ | ADRB2 | P07550 | 3/20 | 0.53 |
| ▸ | ADRB1 | P08588 | 3/20 | 0.53 |
| ▸ | ADRB3 | P13945 | 3/20 | 0.53 |
| ▸ | HPGD | P15428 | 3/20 | 0.51 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.51 |
| ▸ | LMNA | P02545 | 3/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.51 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.51 |
| ▸ | HTT | P42858 | 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 | |
|---|---|---|---|---|
| SCHEMBL7996910 | 0.82 | ALDH1A1 (0.55) | KCNH2CACNA1FCHRM2ACHEAGTR1 | |
| SCHEMBL7987761 | 0.82 | ALDH1A1 (0.55) | KCNH2CACNA1FCHRM2ACHEAGTR1 | |
| N-Desmethyldofetilide SCHEMBL7853191 | 0.81 | KCNH2 (0.64) | KCNH2CACNA1FCHRM2ACHEAGTR1 | |
| SCHEMBL1449931 | 0.79 | PGR (0.67) | NPC1RAB9AHPGDSMN1; SMN2LMNA | |
| SCHEMBL7987756 | 0.79 | HPGD (0.67) | HPGD | |
| SCHEMBL7987755 | 0.79 | HPGD (0.67) | HPGD | |
| SCHEMBL394895 | 0.79 | ALDH1A1 (0.61) | HPGDSMN1; SMN2LMNAALDH1A1KDM4E | |
| SCHEMBL2231178 | 0.78 | ALDH1A1 (0.66) | RAB9AHPGDSMN1; SMN2LMNAALDH1A1 | |
| SCHEMBL2231854 | 0.78 | ALDH1A1 (0.61) | KCNH2DRD3NPC1RAB9AHPGD | |
| SCHEMBL2231514 | 0.78 | ALDH1A1 (0.63) | KCNH2NPC1RAB9AHPGDSMN1; SMN2 |
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 |
|---|---|---|---|---|---|---|---|
| US-6288096-B1 | ANTIDIABETIC AGENTS, HYPOTENSIVE AGENTS, AND ANTICHOLESTEROL AGENTS | ASTRAZENECA AB (SE) | 2001-09-11 | — | — | US | disclosed |