Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CRHR1 | P34998 | 1/20 | 0.40 |
| ▸ | CDK1 | P06493 | 1/20 | 0.38 |
| ▸ | CCNB1 | P14635 | 1/20 | 0.38 |
| ▸ | CCNE1 | P24864 | 1/20 | 0.38 |
| ▸ | CDK2 | P24941 | 1/20 | 0.38 |
| ▸ | ESR1 | P03372 | 1/20 | 0.36 |
| ▸ | PARP1 | P09874 | 1/20 | 0.35 |
| ▸ | ACACB | O00763 | 9/20 | 0.35 |
| ▸ | ROCK1 | Q13464 | 3/20 | 0.35 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.35 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.35 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.34 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.34 |
| ▸ | PI4KA | P42356 | 1/20 | 0.33 |
| ▸ | PI4K2B | Q8TCG2 | 1/20 | 0.33 |
| ▸ | PI4K2A | Q9BTU6 | 1/20 | 0.33 |
| ▸ | PI4KB | Q9UBF8 | 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 | |
|---|---|---|---|---|
| SCHEMBL2946534 | 0.84 | CRHR1 (0.41) | CRHR1CDK1CCNB1CCNE1CDK2 | |
| SCHEMBL2953257 | 0.80 | CDK1 (0.42) | CRHR1CDK1CCNB1CCNE1CDK2 | |
| SCHEMBL2953442 | 0.75 | HRH4 (0.42) | ESR1PARP1ADORA2A | |
| SCHEMBL2952316 | 0.74 | NPC1 (0.51) | ADORA2A | |
| SCHEMBL2955314 | 0.73 | HRH3 (0.47) | ESR1PARP1ACACBADORA2AHRH3 | |
| SCHEMBL2946224 | 0.72 | CDK1 (0.40) | CDK1CCNB1CCNE1CDK2KCNH2 | |
| SCHEMBL2950527 | 0.72 | ADORA2A (0.42) | CDK1CCNB1CCNE1CDK2ADORA2A | |
| SCHEMBL2950165 | 0.70 | TLR7 (0.41) | CDK1CCNB1CCNE1CDK2PI4KA | |
| SCHEMBL2955288 | 0.69 | TLR7 (0.42) | CDK1CCNB1CCNE1CDK2PI4KA | |
| SCHEMBL2951209 | 0.68 | KDM4E (0.42) | CDK1CCNB1CCNE1CDK2PI4KA |
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 |