Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CASP3 | P42574 | 7/20 | 0.50 |
| ▸ | CASP6 | P55212 | 6/20 | 0.50 |
| ▸ | CASP8 | Q14790 | 6/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.46 |
| ▸ | LPAR1 | Q92633 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | THRB | P10828 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL5493805 | 0.86 | CASP3 (0.53) | CASP3CASP6CASP8ALDH1A1LPAR1 | |
| SCHEMBL8360434 | 0.86 | ALDH1A1 (0.54) | CASP3CASP6CASP8ALDH1A1SMN1; SMN2 | |
| SCHEMBL6448297 | 0.80 | ALDH1A1 (0.55) | CASP3CASP6CASP8ALDH1A1LPAR1 | |
| SCHEMBL5497665 | 0.78 | ALDH1A1 (0.57) | CASP3CASP6CASP8ALDH1A1LPAR1 | |
| SCHEMBL22390739 | 0.78 | ALDH1A1 (0.57) | CASP3CASP6CASP8ALDH1A1LPAR1 | |
| SCHEMBL8177381 | 0.77 | ALDH1A1 (0.49) | CASP3CASP6CASP8ALDH1A1LPAR1 | |
| SCHEMBL75658 | 0.76 | POLB (0.60) | ALDH1A1SMN1; SMN2THRBMEN1CYP2C9 | |
| SCHEMBL5497672 | 0.75 | LPAR1 (0.52) | ALDH1A1LPAR1THRBKMT2AGAA | |
| SCHEMBL5493808 | 0.72 | ALDH1A1 (0.53) | CASP3CASP6CASP8ALDH1A1LPAR1 | |
| SCHEMBL4422637 | 0.72 | ALDH1A1 (0.55) | ALDH1A1LPAR1THRBKMT2AGAA |
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 |
|---|---|---|---|---|---|---|---|
| WO-2003008374-A1 | INHIBITORS OF THE ICE/CED-3 FAMILY OF CYSTEINE PROTEASES | IDUN PHARMACEUTICALS, INC. (US) | 2003-01-30 | — | — | WO | disclosed |