Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAF1 | P04049 | 1/20 | 0.47 |
| ▸ | F10 | P00742 | 8/20 | 0.46 |
| ▸ | F2 | P00734 | 5/20 | 0.44 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.41 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.41 |
| ▸ | CA12 | O43570 | 2/20 | 0.40 |
| ▸ | CA1 | P00915 | 2/20 | 0.40 |
| ▸ | CA9 | Q16790 | 2/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | CES2 | O00748 | 1/20 | 0.39 |
| ▸ | CES1 | P23141 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL341880 | 0.83 | KMT2A (0.53) | RAF1HSP90AA1HSP90AB1CA12CA1 | |
| SCHEMBL2989104 | 0.83 | AKR1C3 (0.53) | HSP90AA1HSP90AB1CA12CA1CA9 | |
| SCHEMBL2981524 | 0.82 | HSP90AA1 (0.43) | HSP90AA1HSP90AB1CA12CA1CA9 | |
| SCHEMBL25984931 | 0.82 | PARP1 (0.58) | F10F2HSP90AA1HSP90AB1CA12 | |
| SCHEMBL30785086 | 0.81 | STS (0.50) | HSP90AA1HSP90AB1ALDH1A1HPGDMEN1 | |
| SCHEMBL4346540 | 0.81 | L3MBTL1 (0.50) | ALDH1A1HPGDSMN1; SMN2MEN1KMT2A | |
| SCHEMBL21280074 | 0.81 | HSP90AA1 (0.42) | HSP90AA1HSP90AB1CA12CA1CA9 | |
| SCHEMBL2982620 | 0.81 | ESR1 (0.42) | HSP90AA1HSP90AB1CA12CA1CA9 | |
| SCHEMBL6974213 | 0.80 | MAPT (0.60) | HSP90AA1HSP90AB1ALDH1A1HPGDSMN1; SMN2 | |
| SCHEMBL555801 | 0.79 | GSK3B (0.48) | HSP90AA1HSP90AB1CA12CA1CA9 |
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-2011158149-A1 | 2-(3,5-DISUBSTITUTEDPHENYL)PYRIMIDIN-4(3H)-ONE DERIVATIVES | PFIZER INC. (US) | 2011-12-22 | — | — | WO | disclosed |