Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE | P22303 | 3/20 | 0.40 |
| ▸ | SIGMAR1 | Q99720 | 5/20 | 0.37 |
| ▸ | MDM2 | Q00987 | 1/20 | 0.35 |
| ▸ | NPC1 | O15118 | 1/20 | 0.34 |
| ▸ | RAB9A | P51151 | 1/20 | 0.34 |
| ▸ | ITGB1 | P05556 | 1/20 | 0.34 |
| ▸ | ITGA4 | P13612 | 1/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | OPRM1 | P35372 | 4/20 | 0.33 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.33 |
| ▸ | OGA | O60502 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL14028658 | 0.92 | SIGMAR1 (0.41) | ACHESIGMAR1MDM2 | |
| SCHEMBL14174172 | 0.87 | SORT1 (0.38) | ACHESIGMAR1MDM2CYP2C9CYP2C19 | |
| SCHEMBL14028656 | 0.83 | TSHR (0.39) | ACHESIGMAR1TSHROPRM1 | |
| SCHEMBL13503873 | 0.78 | ACHE (0.33) | ACHESIGMAR1NPC1RAB9ACYP2C9 | |
| SCHEMBL14168752 | 0.74 | ITGB1 (0.40) | ITGB1ITGA4KCNH2 | |
| SCHEMBL5059048 | 0.71 | SCN1A (0.36) | ACHESIGMAR1ITGB1ITGA4LMNA | |
| SCHEMBL5126954 | 0.71 | OPRD1 (0.48) | ACHETSHR | |
| 5-Methyl-3-Phenethyl-5-Phenyl-4,5-Dihydroisoxazole (Enantiomeric Mix) SCHEMBL2921112 | 0.71 | ITGB1 (0.38) | SIGMAR1ITGB1ITGA4OPRM1KCNH2 | |
| SCHEMBL13503810 | 0.69 | TSHR (0.36) | ACHESIGMAR1LMNATSHROPRM1 | |
| SCHEMBL12516740 | 0.65 | ALDH1A1 (0.40) | SIGMAR1 |
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-7449485-B2 | N-sulfonylurea apoptosis promoters | ABBOTT LABORATORIES INC. (US) | 2008-11-11 | — | — | US | disclosed |