Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDK1 | P06493 | 12/20 | 0.66 |
| ▸ | CCNB1 | P14635 | 12/20 | 0.66 |
| ▸ | CCNA2 | P20248 | 12/20 | 0.66 |
| ▸ | CDK2 | P24941 | 12/20 | 0.66 |
| ▸ | CCNA1 | P78396 | 12/20 | 0.66 |
| ▸ | MGMT | P16455 | 7/20 | 0.66 |
| ▸ | PIN1 | Q13526 | 7/20 | 0.66 |
| ▸ | LMNA | P02545 | 1/20 | 0.66 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.66 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.66 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.66 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.66 |
| ▸ | TSHR | P16473 | 1/20 | 0.66 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.66 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.66 |
| ▸ | BLM | P54132 | 1/20 | 0.66 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.66 |
| ▸ | PDPK1 | O15530 | 1/20 | 0.51 |
| ▸ | GDA | Q9Y2T3 | 1/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL29460225 | 1.00 | CDK1 (0.66) | CDK1CCNB1CCNA2CDK2CCNA1 | |
| SCHEMBL3306752 | 0.85 | PIN1 (0.67) | CDK1CCNB1CCNA2CDK2CCNA1 | |
| 6-O-Benzylguanine SCHEMBL31517079 | 0.79 | PIN1 (1.00) | CDK1CCNB1CCNA2CDK2CCNA1 | |
| 6-O-Benzylguanine SCHEMBL61740 | 0.79 | PIN1 (1.00) | CDK1CCNB1CCNA2CDK2CCNA1 | |
| 6-O-Benzylguanine SCHEMBL4631744 | 0.78 | PIN1 (0.97) | CDK1CCNB1CCNA2CDK2CCNA1 | |
| SCHEMBL8619367 | 0.77 | CDK1 (0.66) | CDK1CCNB1CCNA2CDK2CCNA1 | |
| SCHEMBL851965 | 0.76 | PIN1 (0.78) | CDK1CCNB1CCNA2CDK2CCNA1 | |
| SCHEMBL2930276 | 0.76 | CDK1 (0.62) | CDK1CCNB1CCNA2CDK2CCNA1 | |
| SCHEMBL9458749 | 0.76 | ADORA3 (0.55) | CDK1CCNB1CCNA2CDK2CCNA1 | |
| SCHEMBL9681378 | 0.76 | TRPA1 (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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5153318-A | Viricides for hepatitis and human t-cell leukemia/lymphoma viruses | BURROUGHS WELLCOME CO. (US) | 1992-10-06 | — | — | US | disclosed |
| EP-0421739-A1 | 3'-azido purine nucleoside | THE WELLCOME FOUNDATION LIMITED (GB) | 1991-04-10 | — | — | EP | disclosed |