Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
| ▸ | MGLL | Q99685 | 1/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.30 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.30 |
| ▸ | ALDH1A1 | P00352 | 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 | |
|---|---|---|---|---|
| SCHEMBL8384810 | 0.71 | LMNA (0.33) | TSHRMAPTHPGDSMN1; SMN2MGLL | |
| SCHEMBL8380814 | 0.71 | MAPT (0.32) | MAPTHPGDSMN1; SMN2MGLLHSD17B10 | |
| SCHEMBL8383799 | 0.69 | MAPT (0.30) | MAPTHPGDSMN1; SMN2MGLLHSD17B10 | |
| SCHEMBL8380376 | 0.65 | MAPK1 (0.32) | ALDH1A1 | |
| SCHEMBL8383978 | 0.65 | TP53 (0.36) | MAPTHPGDSMN1; SMN2MGLLHSD17B10 | |
| SCHEMBL8381569 | 0.65 | — | — | |
| SCHEMBL2783701 | 0.65 | — | — | |
| SCHEMBL297217 | 0.65 | TSHR (0.39) | TSHRMAPTHPGDSMN1; SMN2MGLL | |
| SCHEMBL203456 | 0.65 | — | — | |
| SCHEMBL3482296 | 0.63 | ALDH1A1 (0.40) | TSHRMAPTHPGDSMN1; SMN2MGLL |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2217564-A1 | COMPLEX PANTOIC ACID ESTER NEOPENTYL SULFONYL ESTER CYCLIZATION RELEASE PRODRUGS OF ACAMPROSATE, COMPOSITIONS THEREOF, AND METHODS OF USE | XenoPort, Inc. (US) | 2010-08-18 | — | — | EP | disclosed |
| WO-2009033054-A1 | COMPLEX PANTOIC ACID ESTER NEOPENTYL SULFONYL ESTER CYCLIZATION RELEASE PRODRUGS OF ACAMPROSATE, COMPOSITIONS THEREOF, AND METHODS OF USE | XENOPORT, INC. (US) | 2009-03-12 | — | — | WO | disclosed |