Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CASP1 | P29466 | 1/20 | 0.35 |
| ▸ | CASP5 | P51878 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.34 |
| ▸ | LMNA | P02545 | 2/20 | 0.34 |
| ▸ | HPGD | P15428 | 2/20 | 0.33 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.33 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.33 |
| ▸ | PIK3CB | P42338 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.33 |
| ▸ | EPAS1 | Q99814 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.32 |
| ▸ | MAPT | P10636 | 2/20 | 0.32 |
| ▸ | STAT3 | P40763 | 1/20 | 0.32 |
| ▸ | CNR2 | P34972 | 1/20 | 0.32 |
| ▸ | CETP | P11597 | 1/20 | 0.32 |
| ▸ | DGAT1 | O75907 | 1/20 | 0.32 |
| ▸ | SOAT1 | P35610 | 1/20 | 0.32 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL4706730 | 0.86 | PIK3CD (0.36) | CASP1CASP5ALDH1A1KDM4ELMNA | |
| SCHEMBL4708291 | 0.78 | HPGD (0.39) | ALDH1A1KDM4ELMNAHPGDGAA | |
| SCHEMBL4706583 | 0.77 | HTT (0.36) | CASP1CASP5LMNAMAPTNPSR1 | |
| SCHEMBL4708213 | 0.77 | USP2 (0.44) | ALDH1A1LMNAHIF1ASMN1; SMN2 | |
| SCHEMBL4705254 | 0.73 | ALDH1A1 (0.41) | ALDH1A1GAATACR1 | |
| SCHEMBL4804309 | 0.72 | PAX8 (0.35) | CASP1CASP5ALDH1A1KDM4ELMNA | |
| SCHEMBL4708361 | 0.72 | USP2 (0.37) | ALDH1A1HIF1ASMN1; SMN2 | |
| SCHEMBL4707339 | 0.69 | POLB (0.39) | — | |
| SCHEMBL4708394 | 0.68 | RXFP1 (0.44) | ALDH1A1LMNAHPGDGAASMN1; SMN2 | |
| SCHEMBL5797687 | 0.68 | CASP1 (0.43) | CASP1CASP5ALDH1A1HPGDGAA |
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-1501809-B1 | TRIAZOLE DERIVATIVES AS TACHYKININ RECEPTOR ANTAGONISTS | LILLY CO ELI (US) | 2008-01-16 | — | — | EP | disclosed |