Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LMNA | P02545 | 2/20 | 0.42 |
| ▸ | HPGD | P15428 | 3/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 2/20 | 0.38 |
| ▸ | TP53 | P04637 | 1/20 | 0.38 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.38 |
| ▸ | CACNA1B | Q00975 | 1/20 | 0.38 |
| ▸ | S1PR1 | P21453 | 3/20 | 0.37 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.37 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | P2RY1 | P47900 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | PPARA | Q07869 | 2/20 | 0.36 |
| ▸ | PPARG | P37231 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL6154582 | 0.92 | CETP (0.41) | LMNAHPGDHSD17B10NPC1MAPT | |
| SCHEMBL6155264 | 0.90 | CETP (0.40) | LMNAHPGDHSD17B10NPC1MAPT | |
| SCHEMBL6153971 | 0.89 | S1PR1 (0.40) | LMNAHPGDHSD17B10NPC1CACNA1B | |
| SCHEMBL6155267 | 0.88 | HSD17B10 (0.40) | LMNAHPGDHSD17B10NPC1CACNA1B | |
| SCHEMBL6154990 | 0.87 | P2RY1 (0.40) | LMNAHPGDHSD17B10NPC1MAPT | |
| SCHEMBL6155070 | 0.80 | PTPN5 (0.45) | LMNAHPGDHSD17B10NPC1ROCK2 | |
| SCHEMBL6155036 | 0.80 | HSD17B10 (0.38) | LMNAHPGDHSD17B10NPC1S1PR1 | |
| SCHEMBL6154034 | 0.79 | KMO (0.47) | LMNAHPGDHSD17B10NPC1ROCK2 | |
| SCHEMBL6154252 | 0.78 | GCGR (0.39) | LMNAHPGDHSD17B10NPC1MAPT | |
| SCHEMBL4955510 | 0.77 | NR1H2 (0.38) | LMNAHPGDHSD17B10NPC1S1PR1 |
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-1446110-A2 | ORGANOSULFUR INHIBITORS OF TYROSINE PHOSPHATASES | Structural Bioinformatics Inc. (US) | 2004-08-18 | — | — | EP | disclosed |
| WO-2003032916-A2 | ORGANOSULFUR INHIBITORS OF TYROSINE PHOSPHATASES | STRUCTURAL BIOINFORMATICS INC. (US) | 2003-04-24 | — | — | WO | disclosed |