Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 2/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.33 |
| ▸ | MME | P08473 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.30 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.30 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.30 |
| ▸ | CHRM3 | P20309 | 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 | |
|---|---|---|---|---|
| SCHEMBL5778952 | 0.83 | TSHR (0.39) | TSHRMEN1KMT2AMMEALDH1A1 | |
| SCHEMBL1564220 | 0.80 | ALDH1A1 (0.40) | MEN1KMT2AMMEALDH1A1CHRM4 | |
| SCHEMBL13349402 | 0.73 | TSHR (0.34) | TSHRMEN1KMT2A | |
| SCHEMBL9818578 | 0.73 | ALDH1A1 (0.34) | MEN1KMT2AMMEALDH1A1 | |
| SCHEMBL14872129 | 0.73 | ALDH1A1 (0.34) | MEN1KMT2AMMEALDH1A1 | |
| SCHEMBL4597186 | 0.72 | SMN1; SMN2 (0.48) | TSHRMEN1KMT2AMMEALDH1A1 | |
| SCHEMBL4597189 | 0.72 | SMN1; SMN2 (0.48) | TSHRMEN1KMT2AMMEALDH1A1 | |
| SCHEMBL2441047 | 0.71 | FAAH (0.36) | TSHRALDH1A1 | |
| SCHEMBL22636281 | 0.71 | POLB (0.33) | — | |
| SCHEMBL22636279 | 0.71 | POLB (0.33) | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1709037-A2 | HIV PROTEASE INHIBITING SULFONAMIDES | ABBOTT LABORATORIES (US) | 2006-10-11 | — | — | EP | disclosed |
| EP-1697344-A2 | HIV PROTEASE INHIBITING COMPOUNDS | ABBOTT LABORATORIES (US) | 2006-09-06 | — | — | EP | disclosed |
| WO-2005061450-A2 | HIV PROTEASE INHIBITING SULFONAMIDES | ABBOTT LABORATORIES (US) | 2005-07-07 | — | — | WO | disclosed |
| WO-2005058841-A2 | HIV PROTEASE INHIBITING COMPOUNDS | ABBOTT LABORATORIES (US) | 2005-06-30 | — | — | WO | disclosed |