Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C19 | P33261 | 1/20 | 0.44 |
| ▸ | TSHR | P16473 | 2/20 | 0.42 |
| ▸ | ACHE | P22303 | 2/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.41 |
| ▸ | CA12 | O43570 | 1/20 | 0.40 |
| ▸ | CA9 | Q16790 | 1/20 | 0.40 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 2/20 | 0.37 |
| ▸ | TRPM8 | Q7Z2W7 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.35 |
| ▸ | RELA | Q04206 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | ADORA1 | P30542 | 2/20 | 0.35 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL11506881 | 0.89 | ALDH1A1 (0.41) | CYP2C19TSHRLMNAALDH1A1RAB9A | |
| SCHEMBL3296625 | 0.86 | ALDH1A1 (0.42) | CYP2C19TSHRLMNAALDH1A1HPGD | |
| SCHEMBL4634298 | 0.78 | CA12 (0.44) | CYP2C19TSHRACHELMNAALOX12 | |
| SCHEMBL28021091 | 0.76 | ALDH1A1 (0.46) | CYP2C19LMNAALDH1A1TRPM8NPC1 | |
| SCHEMBL13990423 | 0.74 | ALDH1A1 (0.56) | CYP2C19TSHRACHELMNAALOX12 | |
| SCHEMBL12154508 | 0.74 | ALDH1A1 (0.56) | CYP2C19TSHRACHELMNAALOX12 | |
| SCHEMBL6264147 | 0.74 | TSHR (0.53) | CYP2C19TSHRACHELMNAALOX12 | |
| SCHEMBL16707568 | 0.74 | ALDH1A1 (0.56) | CYP2C19TSHRACHELMNAALOX12 | |
| SCHEMBL43023 | 0.74 | ALDH1A1 (0.56) | CYP2C19TSHRACHELMNAALOX12 | |
| SCHEMBL6139963 | 0.74 | ALDH1A1 (0.56) | CYP2C19TSHRACHELMNAALOX12 |
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-5274104-A | N-substituted heterocyclic derivatives useful in the treatment of cardiovascular disorders | ELF SANOFI, A FRENCH CORP. (FR) | 1993-12-28 | — | — | US | disclosed |