Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSP90AA1 | P07900 | 2/20 | 0.47 |
| ▸ | HSP90AB1 | P08238 | 2/20 | 0.47 |
| ▸ | PI4KA | P42356 | 2/20 | 0.45 |
| ▸ | PI4K2B | Q8TCG2 | 2/20 | 0.45 |
| ▸ | PI4K2A | Q9BTU6 | 2/20 | 0.45 |
| ▸ | PI4KB | Q9UBF8 | 2/20 | 0.45 |
| ▸ | CDK1 | P06493 | 2/20 | 0.42 |
| ▸ | CCNB1 | P14635 | 2/20 | 0.42 |
| ▸ | CCNE1 | P24864 | 2/20 | 0.42 |
| ▸ | CDK2 | P24941 | 2/20 | 0.42 |
| ▸ | XDH | P47989 | 2/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | JAK2 | O60674 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL28861589 | 0.83 | LMNA (0.49) | HSP90AA1HSP90AB1PI4KAPI4K2BPI4K2A | |
| SCHEMBL2954606 | 0.82 | HSP90AA1 (0.41) | HSP90AA1HSP90AB1CDK1CCNB1CCNE1 | |
| SCHEMBL28861601 | 0.80 | PI4KA (0.68) | PI4KAPI4K2BPI4K2API4KBCDK1 | |
| SCHEMBL30399128 | 0.80 | FYN (0.41) | HSP90AA1HSP90AB1GAA | |
| SCHEMBL27870409 | 0.80 | PI4KA (0.70) | PI4KAPI4K2BPI4K2API4KBXDH | |
| SCHEMBL2954051 | 0.79 | DHFR (0.44) | HSP90AA1HSP90AB1PI4KAPI4K2BPI4K2A | |
| SCHEMBL2952950 | 0.79 | DHFR (0.43) | HSP90AA1HSP90AB1MEN1JAK2KMT2A | |
| SCHEMBL2946224 | 0.76 | CDK1 (0.40) | HSP90AA1HSP90AB1CDK1CCNB1CCNE1 | |
| SCHEMBL2956345 | 0.75 | PDE4B (0.42) | HSP90AA1HSP90AB1PI4KBCDK1CDK2 | |
| SCHEMBL2953676 | 0.74 | EGFR (0.39) | — |
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-2010111406-A2 | COMPOUNDS AND THERAPEUTIC USES THEREOF | MYRIAD PHARMACEUTICALS, INC. (US) | 2010-09-30 | — | — | WO | claimed |