Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.32 |
| ▸ | CHRNB4 | P30926 | 2/20 | 0.30 |
| ▸ | CHRNA3 | P32297 | 2/20 | 0.30 |
| ▸ | NPC1 | O15118 | 1/20 | 0.30 |
| ▸ | MAPT | P10636 | 1/20 | 0.30 |
| ▸ | RAB9A | P51151 | 1/20 | 0.30 |
| ▸ | SMN1; SMN2 | Q16637 | 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 | |
|---|---|---|---|---|
| SCHEMBL7446269 | 0.81 | HPGD (0.32) | — | |
| SCHEMBL7437340 | 0.77 | CA2 (0.42) | NPC1RAB9A | |
| SCHEMBL7436269 | 0.77 | MAPT (0.43) | ALDH1A1NPC1MAPTRAB9ASMN1; SMN2 | |
| SCHEMBL7437879 | 0.75 | DAO (0.41) | ALDH1A1HSD17B10NPC1MAPTRAB9A | |
| SCHEMBL19931443 | 0.75 | FFAR1 (0.35) | ALDH1A1 | |
| SCHEMBL2487394 | 0.74 | CA2 (0.48) | NPC1 | |
| SCHEMBL7443159 | 0.74 | CA2 (0.48) | NPC1 | |
| SCHEMBL7434681 | 0.74 | HCRTR2 (0.36) | ALDH1A1HSD17B10TDP1NPC1MAPT | |
| SCHEMBL7445863 | 0.74 | MTNR1A (0.44) | ALDH1A1TDP1NPC1MAPTRAB9A | |
| SCHEMBL28609915 | 0.72 | CHRNB4 (0.52) | ALDH1A1CHRNB4CHRNA3NPC1MAPT |
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 |
|---|---|---|---|---|---|---|---|
| US-4558129-A | Benzodioxanyl-hydroxyethylene-piperazinyl acetanilides which effect calcium entry and β-blockade | SYNTEX (U.S.A.) INC. (US) | 1985-12-10 | — | — | US | disclosed |
| US-4499100-A | CARDIOUVASCULAR DISORDERS | SYNTEX (U.S.A.) INC. (US) | 1985-02-12 | — | — | US | disclosed |