Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCNA2 | P20248 | 1/20 | 0.39 |
| ▸ | CDK2 | P24941 | 1/20 | 0.39 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | DHODH | Q02127 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | HTT | P42858 | 1/20 | 0.32 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.32 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | PANK3 | Q9H999 | 3/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL6166211 | 0.85 | CCNA2 (0.50) | CCNA2CDK2OPRM1SMN1; SMN2RAB9A | |
| SCHEMBL6162980 | 0.85 | CCNA2 (0.40) | CCNA2CDK2OPRM1SMN1; SMN2RAB9A | |
| SCHEMBL6165262 | 0.84 | CCNA2 (0.40) | CCNA2CDK2SMN1; SMN2RAB9ADHODH | |
| SCHEMBL6166346 | 0.83 | CCNA2 (0.39) | CCNA2CDK2OPRM1SMN1; SMN2RAB9A | |
| SCHEMBL6164167 | 0.82 | CCNA2 (0.38) | CCNA2CDK2SMN1; SMN2RAB9ADHODH | |
| SCHEMBL6167886 | 0.81 | CCNA2 (0.39) | CCNA2CDK2SMN1; SMN2RAB9ADHODH | |
| SCHEMBL6769850 | 0.80 | OPRM1 (0.38) | OPRM1SMN1; SMN2DHODHKMT2AMEN1 | |
| SCHEMBL6168419 | 0.79 | DHODH (0.42) | CCNA2CDK2OPRM1SMN1; SMN2DHODH | |
| SCHEMBL6770751 | 0.79 | OPRM1 (0.45) | OPRM1SMN1; SMN2DHODHKMT2AMEN1 | |
| SCHEMBL6168332 | 0.79 | ALDH1A1 (0.47) | CCNA2CDK2OPRM1SMN1; SMN2RAB9A |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1177185-B1 | 4, 5, 6, 7-TETRAHYDROINDAZOLE DERIVATIVES AS ANTITUMOR AGENTS | PHARMACIA ITALIA SPA (IT) | 2005-04-20 | — | — | EP | disclosed |
| US-6716856-B1 | CELL PROLIFERATIVE DISORDERS OR ALZHEIMER'S DISEASE; REDUCED TOXICITY; CDK/CYCLIN KINASE INHIBITORY ACTIVITY | PHARMACIA & TUBJOHN SPA (IT) | 2004-04-06 | — | — | US | disclosed |