Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.36 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.36 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.36 |
| ▸ | CHRM2 | P08172 | 3/20 | 0.34 |
| ▸ | CHRM4 | P08173 | 3/20 | 0.34 |
| ▸ | CHRM1 | P11229 | 3/20 | 0.34 |
| ▸ | CHRM3 | P20309 | 3/20 | 0.34 |
| ▸ | CHRM5 | P08912 | 2/20 | 0.34 |
| ▸ | MAOB | P27338 | 8/20 | 0.32 |
| ▸ | MAOA | P21397 | 7/20 | 0.32 |
| ▸ | KDM1A | O60341 | 5/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 4/20 | 0.32 |
| ▸ | CYP2B6 | P20813 | 3/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.32 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.32 |
| ▸ | TAAR1 | Q96RJ0 | 2/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL7547948 | 0.91 | SLC6A3 (0.36) | TSHRSLC6A2SLC6A3SLC6A4MAOB | |
| SCHEMBL7552162 | 0.84 | EPHX1 (0.41) | CYP2C19CYP2D6CYP2C9LMNACYP3A4 | |
| SCHEMBL7550250 | 0.84 | TSHR (0.41) | TSHRSLC6A2SLC6A3SLC6A4MAOB | |
| SCHEMBL7550412 | 0.73 | CFTR (0.39) | POLB | |
| SCHEMBL7550942 | 0.71 | SLC6A2 (0.45) | TSHRSLC6A2SLC6A3SLC6A4CHRM2 | |
| SCHEMBL3189756 | 0.70 | MAOB (0.48) | SLC6A2SLC6A3MAOBMAOAKDM1A | |
| SCHEMBL3189760 | 0.70 | MAOB (0.48) | SLC6A2SLC6A3MAOBMAOAKDM1A | |
| SCHEMBL7555123 | 0.70 | CFTR (0.44) | CHRM2CHRM4CHRM1CHRM3CHRM5 | |
| SCHEMBL28117704 | 0.68 | TSHR (0.36) | TSHRSLC6A2SLC6A3SLC6A4MAOB | |
| SCHEMBL28066085 | 0.68 | TSHR (0.36) | TSHRCHRM2CHRM4CHRM1CHRM3 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2002051883-A1 | SYNTHESIS OF NOVEL HETEROCYCLIC MOLECULES OXYGENATED BY METATHESIS REACTION ON SOLID SUPPORT USING NOVEL SILYLATED LINKERS | AVENTIS PHARMA S.A. (FR) | 2002-07-04 | — | — | WO | disclosed |