Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.44 |
| ▸ | GGPS1 | O95749 | 6/20 | 0.41 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.41 |
| ▸ | ADH1B | P00325 | 1/20 | 0.41 |
| ▸ | ADH1C | P00326 | 1/20 | 0.41 |
| ▸ | ADH1A | P07327 | 1/20 | 0.41 |
| ▸ | ADH4 | P08319 | 1/20 | 0.41 |
| ▸ | ADH7 | P40394 | 1/20 | 0.41 |
| ▸ | FDPS | P14324 | 9/20 | 0.40 |
| ▸ | THRB | P10828 | 1/20 | 0.40 |
| ▸ | FAAH | O00519 | 2/20 | 0.39 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.39 |
| ▸ | CES2 | O00748 | 1/20 | 0.39 |
| ▸ | LPAR1 | Q92633 | 1/20 | 0.39 |
| ▸ | LPAR3 | Q9UBY5 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL3896366 | 0.95 | TSHR (0.42) | TSHRGGPS1EPHX1ADH1BADH1C | |
| SCHEMBL7735780 | 0.93 | TSHR (0.42) | TSHRGGPS1EPHX1ADH1BADH1C | |
| SCHEMBL28626292 | 0.93 | TSHR (0.42) | TSHRGGPS1EPHX1ADH1BADH1C | |
| SCHEMBL28422225 | 0.91 | TSHR (0.41) | TSHRGGPS1EPHX1ADH1BADH1C | |
| SCHEMBL28171004 | 0.88 | TSHR (0.37) | TSHRGGPS1EPHX1ADH1BADH1C | |
| SCHEMBL1714213 | 0.88 | TSHR (0.42) | TSHRGGPS1EPHX1ADH1BADH1C | |
| SCHEMBL11170814 | 0.87 | TSHR (0.38) | TSHREPHX1ADH1BADH1CADH1A | |
| SCHEMBL20873211 | 0.87 | GGPS1 (0.41) | TSHRGGPS1FDPSCES2LPAR1 | |
| SCHEMBL11120624 | 0.86 | CES2 (0.39) | GGPS1FDPSCES2LPAR1LPAR3 | |
| SCHEMBL28211171 | 0.85 | TSHR (0.39) | TSHRGGPS1EPHX1ADH1BADH1C |
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 |
|---|---|---|---|---|---|---|---|
| EP-0690856-B1 | ANTI-TUMOR COMPOUNDS, PHARMACEUTICAL COMPOSITIONS, METHODS FOR PREPARATION THEREOF AND FOR TREATMENT | UNIV NEW YORK STATE RES FOUND (US) | 2002-12-04 | — | — | EP | claimed |