Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ENPP1 | P22413 | 1/20 | 0.40 |
| ▸ | CCNA2 | P20248 | 7/20 | 0.38 |
| ▸ | CDK2 | P24941 | 7/20 | 0.38 |
| ▸ | CDK1 | P06493 | 4/20 | 0.36 |
| ▸ | CCNB1 | P14635 | 4/20 | 0.36 |
| ▸ | CCNA1 | P78396 | 3/20 | 0.36 |
| ▸ | NUDT1 | P36639 | 1/20 | 0.34 |
| ▸ | MGMT | P16455 | 2/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL5484380 | 0.81 | PNP (0.44) | ENPP1CCNA2CDK2CDK1CCNB1 | |
| SCHEMBL6481197 | 0.75 | NUDT1 (0.35) | NUDT1 | |
| SCHEMBL4907123 | 0.75 | PDPK1 (0.44) | — | |
| Water SCHEMBL8757461 | 0.73 | PDPK1 (0.42) | — | |
| SCHEMBL9500288 | 0.71 | PNP (0.41) | ENPP1 | |
| SCHEMBL9503841 | 0.71 | PDPK1 (0.51) | NUDT1 | |
| Methylguanine SCHEMBL29903462 | 0.68 | CDK1 (0.69) | CCNA2CDK2CDK1CCNB1CCNA1 | |
| Methylguanine SCHEMBL231097 | 0.68 | CDK1 (0.69) | CCNA2CDK2CDK1CCNB1CCNA1 | |
| SCHEMBL7453052 | 0.68 | CCNA2 (0.36) | CCNA2CDK2CDK1CCNB1CCNA1 | |
| SCHEMBL16828211 | 0.65 | CCNA2 (0.42) | CCNA2CDK2CCNA1NUDT1 |
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-0539487-A1 | ANTIVIRAL PHOSPHONO-ALKEN DERIVATIVES OF PURINES | BEECHAM GROUP PLC (GB) | 1993-05-05 | — | — | EP | disclosed |
| WO-1992001698-A1 | ANTIVIRAL PHOSPHONO-ALKEN DERIVATIVES OF PURINES | BEECHAM GROUP PLC (GB) | 1992-02-06 | — | — | WO | disclosed |