Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 2/20 | 0.39 |
| ▸ | MITF | O75030 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | MTOR | P42345 | 1/20 | 0.37 |
| ▸ | EGFR | P00533 | 2/20 | 0.37 |
| ▸ | HTR7 | P34969 | 2/20 | 0.37 |
| ▸ | GAA | P10253 | 2/20 | 0.36 |
| ▸ | GPR139 | Q6DWJ6 | 1/20 | 0.36 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.36 |
| ▸ | SLC6A9 | P48067 | 1/20 | 0.36 |
| ▸ | SLC6A5 | Q9Y345 | 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 | |
|---|---|---|---|---|
| SCHEMBL7784931 | 0.91 | SIGMAR1 (0.42) | ALDH1A1KDM4ECYP3A4LMNAMAPT | |
| SCHEMBL7780579 | 0.91 | SIGMAR1 (0.42) | ALDH1A1KDM4ECYP3A4LMNAMAPT | |
| SCHEMBL7787615 | 0.90 | MAPKAPK2 (0.33) | NPC1CYP3A4CYP2D6SLC6A9SLC6A5 | |
| SCHEMBL7787788 | 0.90 | CASR (0.37) | ALDH1A1LMNAMTORGAASLC6A9 | |
| SCHEMBL7780536 | 0.89 | IDO1 (0.39) | ALDH1A1LMNAMTORGAAGPR139 | |
| SCHEMBL28746788 | 0.89 | SLC6A2 (0.41) | ALDH1A1LMNAKMT2AMTORGAA | |
| SCHEMBL7780766 | 0.89 | IDO1 (0.39) | ALDH1A1LMNAMTORGAAGPR139 | |
| SCHEMBL7780426 | 0.89 | SLC6A2 (0.41) | ALDH1A1LMNAKMT2AMTORGAA | |
| SCHEMBL7780321 | 0.88 | KMT2A (0.48) | ALDH1A1CYP3A4CYP2D6CYP2C9CYP2C19 | |
| SCHEMBL7785470 | 0.88 | TRPM8 (0.32) | NPC1ALDH1A1CYP3A4CYP2D6LMNA |
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 |
|---|---|---|---|---|---|---|---|
| US-6329405-B1 | AS ILEAL BILE ACID TRANSPORTER INHIBITOR, FOR THERAPY OF HYPERLIPEMIA | SANKYO COMPANY, LIMITED (JP) | 2001-12-11 | — | — | US | disclosed |
| EP-1070703-A1 | Cyclobutene derivatives | Sankyo Company Limited (JP) | 2001-01-24 | — | — | EP | disclosed |