Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKR1C3 | P42330 | 10/20 | 0.64 |
| ▸ | AKR1C2 | P52895 | 10/20 | 0.64 |
| ▸ | AKR1C1 | Q04828 | 1/20 | 0.54 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.54 |
| ▸ | KCNQ2 | O43526 | 1/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.47 |
| ▸ | LMNA | P02545 | 1/20 | 0.47 |
| ▸ | HTT | P42858 | 1/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.47 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL30730198 | 1.00 | AKR1C3 (0.64) | AKR1C3AKR1C2AKR1C1PTGS1KCNQ2 | |
| SCHEMBL14192004 | 1.00 | AKR1C3 (0.64) | AKR1C3AKR1C2AKR1C1PTGS1KCNQ2 | |
| SCHEMBL9242973 | 0.88 | AKR1C3 (0.64) | AKR1C3AKR1C2AKR1C1PTGS1 | |
| SCHEMBL11192581 | 0.86 | AKR1C3 (0.54) | AKR1C3AKR1C2AKR1C1PTGS1 | |
| SCHEMBL585600 | 0.86 | AKR1C3 (0.54) | AKR1C3AKR1C2AKR1C1PTGS1KCNQ2 | |
| SCHEMBL9063835 | 0.86 | AKR1C3 (0.51) | AKR1C3AKR1C2AKR1C1PTGS1KCNQ2 | |
| SCHEMBL1590616 | 0.85 | AKR1C3 (0.50) | AKR1C3AKR1C2AKR1C1PTGS1KCNQ2 | |
| SCHEMBL22230559 | 0.85 | AKR1C3 (0.56) | AKR1C3AKR1C2AKR1C1PTGS1 | |
| SCHEMBL9064210 | 0.82 | AKR1C3 (0.48) | AKR1C3AKR1C2AKR1C1PTGS1 | |
| SCHEMBL4914159 | 0.82 | AKR1C3 (0.48) | AKR1C3AKR1C2AKR1C1PTGS1KCNQ2 |
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-1684694-A2 | AKT PROTEIN KINASE INHIBITORS | Array Biopharma, Inc. (US) | 2006-08-02 | — | — | EP | disclosed |
| WO-2005051304-A2 | AKT PROTEIN KINASE INHIBITORS | ARRAY BIOPHARMA INC. (US) | 2005-06-09 | — | — | WO | disclosed |