Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CNR1 | P21554 | 1/20 | 0.36 |
| ▸ | CNR2 | P34972 | 1/20 | 0.36 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.35 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.35 |
| ▸ | DHFR | P00374 | 3/20 | 0.34 |
| ▸ | ALK | Q9UM73 | 3/20 | 0.34 |
| ▸ | CDK1 | P06493 | 1/20 | 0.34 |
| ▸ | CCNB1 | P14635 | 1/20 | 0.34 |
| ▸ | CCNE1 | P24864 | 1/20 | 0.34 |
| ▸ | CDK2 | P24941 | 1/20 | 0.34 |
| ▸ | TTK | P33981 | 6/20 | 0.33 |
| ▸ | SUV39H2 | Q9H5I1 | 1/20 | 0.33 |
| ▸ | CCR1 | P32246 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL2953676 | 0.85 | EGFR (0.39) | DHFRALK | |
| SCHEMBL2953492 | 0.83 | TTK (0.47) | ALKTTK | |
| SCHEMBL30399128 | 0.83 | FYN (0.41) | HSP90AA1HSP90AB1DHFR | |
| SCHEMBL2954051 | 0.82 | DHFR (0.44) | HSP90AA1HSP90AB1DHFR | |
| SCHEMBL2952950 | 0.80 | DHFR (0.43) | HSP90AA1HSP90AB1DHFRALKTTK | |
| SCHEMBL2950126 | 0.76 | TTK (0.42) | HSP90AA1HSP90AB1DHFRTTK | |
| SCHEMBL2948890 | 0.74 | TTK (0.45) | HSP90AA1HSP90AB1DHFRALKTTK | |
| SCHEMBL2953119 | 0.74 | TTK (0.43) | ALKTTK | |
| SCHEMBL2946049 | 0.74 | DHFR (0.42) | DHFRCDK1CCNB1CCNE1CDK2 | |
| SCHEMBL3034636 | 0.73 | HSP90AA1 (0.38) | HSP90AA1HSP90AB1ALKCDK1CCNB1 |
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 |