Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNH2 | Q12809 | 1/20 | 0.51 |
| ▸ | CACNA1C | Q13936 | 1/20 | 0.51 |
| ▸ | SCN5A | Q14524 | 1/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.49 |
| ▸ | GAA | P10253 | 3/20 | 0.46 |
| ▸ | MAPT | P10636 | 1/20 | 0.46 |
| ▸ | HPGD | P15428 | 1/20 | 0.46 |
| ▸ | AGTR1 | P30556 | 1/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
| ▸ | CNR1 | P21554 | 1/20 | 0.42 |
| ▸ | EGFR | P00533 | 1/20 | 0.41 |
| ▸ | XPO1 | O14980 | 1/20 | 0.41 |
| ▸ | GRM5 | P41594 | 2/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL14518469 | 0.84 | SCN5A (0.66) | KCNH2CACNA1CSCN5AMAPTCNR1 | |
| SCHEMBL29971364 | 0.77 | CYP1A2 (0.48) | ALDH1A1GAAMAPTHPGDAGTR1 | |
| SCHEMBL2324870 | 0.77 | GRM5 (0.57) | KCNH2CACNA1CSCN5AALDH1A1HPGD | |
| SCHEMBL1646497 | 0.76 | ALDH1A1 (0.51) | ALDH1A1GAAMAPTHPGDAGTR1 | |
| SCHEMBL8348068 | 0.76 | GRM5 (0.50) | KCNH2CACNA1CSCN5AGRM5 | |
| SCHEMBL11446725 | 0.76 | CYP2C19 (0.56) | ALDH1A1GAAMAPTHPGDAGTR1 | |
| SCHEMBL3936695 | 0.76 | — | — | |
| SCHEMBL8351038 | 0.75 | CACNA1C (0.51) | KCNH2CACNA1CSCN5ACNR1GRM5 | |
| SCHEMBL99680 | 0.75 | CACNA1C (0.51) | KCNH2CACNA1CSCN5ACNR1GRM5 | |
| SCHEMBL22937086 | 0.75 | CACNA1C (0.51) | KCNH2CACNA1CSCN5ACNR1GRM5 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2008098857-A1 | 2-AMINOOXAZOLINES AS TAAR1 LIGANDS | F. HOFFMANN-LA ROCHE AG (CH) | 2008-08-21 | — | — | WO | disclosed |
| US-4617397-A | HERBICIDES | TOYO SODA MANUFACTURING CO., LTD. (JP) | 1986-10-14 | — | — | US | disclosed |
| US-4560762-A | HERBICIDE INTERMEDIATES | TOYO SODA MANUFACTURING CO. LTD. (JP) | 1985-12-24 | — | — | US | disclosed |