Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDK1 | P06493 | 8/20 | 0.56 |
| ▸ | CCNB1 | P14635 | 8/20 | 0.56 |
| ▸ | CCNA2 | P20248 | 7/20 | 0.54 |
| ▸ | CDK2 | P24941 | 7/20 | 0.54 |
| ▸ | CCNA1 | P78396 | 7/20 | 0.54 |
| ▸ | PIN1 | Q13526 | 1/20 | 0.49 |
| ▸ | POLA1 | P09884 | 1/20 | 0.46 |
| ▸ | PDPK1 | O15530 | 1/20 | 0.43 |
| ▸ | GDA | Q9Y2T3 | 1/20 | 0.43 |
| ▸ | XDH | P47989 | 4/20 | 0.39 |
| ▸ | NOS1 | P29475 | 1/20 | 0.39 |
| ▸ | PI4KA | P42356 | 1/20 | 0.38 |
| ▸ | PI4K2B | Q8TCG2 | 1/20 | 0.38 |
| ▸ | PI4K2A | Q9BTU6 | 1/20 | 0.38 |
| ▸ | PI4KB | Q9UBF8 | 1/20 | 0.38 |
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.37 |
| ▸ | ADORA2A | P29274 | 2/20 | 0.37 |
| ▸ | PAK1 | Q13153 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL30610405 | 0.90 | CDK1 (0.53) | CDK1CCNB1CCNA2CDK2CCNA1 | |
| SCHEMBL28299226 | 0.88 | POLA1 (0.53) | CDK1CCNB1CCNA2CDK2CCNA1 | |
| Hydrochloric Acid SCHEMBL26629016 | 0.87 | CDK1 (0.51) | CDK1CCNB1CCNA2CDK2CCNA1 | |
| SCHEMBL1074970 | 0.87 | POLA1 (0.57) | CDK1CCNB1CCNA2CDK2CCNA1 | |
| SCHEMBL8252222 | 0.82 | XDH (0.47) | CDK1CCNB1CCNA2CDK2CCNA1 | |
| SCHEMBL8215844 | 0.82 | CDK1 (0.50) | CDK1CCNB1CCNA2CDK2CCNA1 | |
| SCHEMBL8219220 | 0.82 | CDK1 (0.50) | CDK1CCNB1CCNA2CDK2CCNA1 | |
| SCHEMBL29514836 | 0.81 | PDPK1 (0.56) | CDK1CCNB1CCNA2CDK2CCNA1 | |
| SCHEMBL215054 | 0.81 | PDPK1 (0.56) | CDK1CCNB1CCNA2CDK2CCNA1 | |
| SCHEMBL6897929 | 0.80 | CDK1 (0.63) | CDK1CCNB1CCNA2CDK2CCNA1 |
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-2000059906-A1 | AMINOHETEROCYCLE-SUBSTITUTED GLYCEROLS | CLARION PHARMACEUTICALS, INC. (US) | 2000-10-12 | — | — | WO | disclosed |