Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDK1 | P06493 | 3/20 | 0.40 |
| ▸ | CCNB1 | P14635 | 3/20 | 0.40 |
| ▸ | CCNA2 | P20248 | 2/20 | 0.38 |
| ▸ | CDK2 | P24941 | 2/20 | 0.38 |
| ▸ | CCNA1 | P78396 | 2/20 | 0.38 |
| ▸ | NOS1 | P29475 | 1/20 | 0.36 |
| ▸ | PIN1 | Q13526 | 1/20 | 0.34 |
| ▸ | XDH | P47989 | 2/20 | 0.33 |
| ▸ | MCHR1 | Q99705 | 2/20 | 0.33 |
| ▸ | TLR8 | Q9NR97 | 2/20 | 0.33 |
| ▸ | DNM1 | Q05193 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | MAPT | P10636 | 1/20 | 0.30 |
| ▸ | HTT | P42858 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL6897931 | 0.78 | CDK1 (0.46) | CDK1CCNB1CCNA2CDK2CCNA1 | |
| SCHEMBL8215833 | 0.78 | NOS1 (0.38) | CDK1CCNB1CCNA2CDK2CCNA1 | |
| SCHEMBL8219211 | 0.78 | NOS1 (0.38) | CDK1CCNB1CCNA2CDK2CCNA1 | |
| SCHEMBL3878324 | 0.78 | CYP3A4 (0.35) | — | |
| SCHEMBL516302 | 0.78 | ADORA2A (0.39) | CDK1CCNB1ALDH1A1 | |
| SCHEMBL8252218 | 0.76 | XDH (0.33) | CDK1CCNB1CCNA2CDK2CCNA1 | |
| SCHEMBL6036797 | 0.76 | CDK1 (0.34) | CDK1CCNB1CCNA2CDK2CCNA1 | |
| SCHEMBL67129 | 0.74 | CDK1 (0.31) | CDK1CCNB1CCNA2CDK2CCNA1 | |
| SCHEMBL4364337 | 0.73 | CDK1 (0.36) | CDK1CCNB1CCNA2CDK2CCNA1 | |
| SCHEMBL1146060 | 0.72 | CDK1 (0.43) | 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 |