Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 2/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.38 |
| ▸ | HTT | P42858 | 2/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.38 |
| ▸ | PNLIP | P16233 | 1/20 | 0.38 |
| ▸ | MMP13 | P45452 | 1/20 | 0.37 |
| ▸ | NPY5R | Q15761 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 2/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | METAP2 | P50579 | 1/20 | 0.34 |
| ▸ | F2 | P00734 | 1/20 | 0.34 |
| ▸ | PLG | P00747 | 1/20 | 0.34 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.34 |
| ▸ | PRSS2 | P07478 | 1/20 | 0.34 |
| ▸ | PRSS3 | P35030 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL5756749 | 0.92 | POLB (0.41) | NPC1ALDH1A1HTTPNLIPHPGD | |
| SCHEMBL5754702 | 0.89 | CACNA1B (0.34) | NPC1ALDH1A1HTTSMN1; SMN2MAPT | |
| SCHEMBL5755571 | 0.88 | HPGD (0.36) | ALDH1A1HTTSMN1; SMN2PNLIPNPY5R | |
| SCHEMBL5754577 | 0.86 | REN (0.39) | KMT2A | |
| SCHEMBL5755403 | 0.84 | CACNA1B (0.40) | KDM4ECACNA1B | |
| SCHEMBL5755208 | 0.83 | CACNA1B (0.36) | NPC1ALDH1A1HTTSMN1; SMN2MAPT | |
| SCHEMBL5753832 | 0.82 | CACNA1B (0.36) | NPC1PNLIPNPY5RHRH3CACNA1B | |
| SCHEMBL5753729 | 0.81 | ALDH1A1 (0.36) | NPC1ALDH1A1HTTPNLIPHPGD | |
| SCHEMBL5752573 | 0.80 | KDM4E (0.41) | ALDH1A1HTTLMNAKDM4EHPGD | |
| SCHEMBL5759242 | 0.80 | KDM4E (0.41) | ALDH1A1HTTLMNAKDM4EHPGD |
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-0997147-B1 | AMINO ACID DERIVATIVES | ONO PHARMACEUTICAL CO (JP) | 2006-03-15 | — | — | EP | claimed |