Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDK1 | P06493 | 5/20 | 0.58 |
| ▸ | NUDT1 | P36639 | 1/20 | 0.55 |
| ▸ | PRKACA | P17612 | 3/20 | 0.54 |
| ▸ | CDK2 | P24941 | 5/20 | 0.51 |
| ▸ | CCNB1 | P14635 | 4/20 | 0.51 |
| ▸ | CCNA2 | P20248 | 4/20 | 0.51 |
| ▸ | CCNA1 | P78396 | 4/20 | 0.51 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.50 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.50 |
| ▸ | CCNB2 | O95067 | 1/20 | 0.50 |
| ▸ | MAPK3 | P27361 | 1/20 | 0.50 |
| ▸ | CLK1 | P49759 | 1/20 | 0.50 |
| ▸ | CDK5 | Q00535 | 1/20 | 0.50 |
| ▸ | PIN1 | Q13526 | 1/20 | 0.50 |
| ▸ | CCNB3 | Q8WWL7 | 1/20 | 0.50 |
| ▸ | MAP3K5 | Q99683 | 1/20 | 0.50 |
| ▸ | PDPK1 | O15530 | 1/20 | 0.49 |
| ▸ | GDA | Q9Y2T3 | 1/20 | 0.49 |
| ▸ | CHUK | O15111 | 1/20 | 0.48 |
| ▸ | BRAF | P15056 | 5/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL16147021 | 0.79 | CDK1 (0.63) | CDK1NUDT1PRKACACDK2CCNB1 | |
| SCHEMBL8563169 | 0.78 | CHUK (0.52) | CDK1PRKACACDK2CCNB1CCNA2 | |
| SCHEMBL9205057 | 0.78 | HTT (0.59) | CDK2 | |
| SCHEMBL10838746 | 0.78 | NUDT1 (0.67) | CDK1NUDT1PRKACACDK2HDAC1 | |
| SCHEMBL133157 | 0.78 | LMNA (0.54) | CDK1NUDT1CDK2PDPK1GDA | |
| SCHEMBL16146456 | 0.77 | NUDT1 (0.65) | CDK1NUDT1PRKACACDK2CCNB1 | |
| SCHEMBL7626878 | 0.75 | LMNA (0.58) | CDK1CDK2CCNB1CCNA2CCNA1 | |
| SCHEMBL796828 | 0.75 | CDK1 (0.59) | CDK1NUDT1PRKACACDK2CCNB1 | |
| SCHEMBL7621600 | 0.75 | LMNA (0.62) | CDK1CDK2CCNB1CCNA2CCNA1 | |
| SCHEMBL16146485 | 0.75 | CDK1 (0.59) | CDK1NUDT1PRKACACDK2CCNB1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5817639-A | VIRICIDES | YAMASA CORPORATION (JP) | 1998-10-06 | — | — | US | disclosed |
| US-5811408-A | ANTITUMOR AND ANTICARCINOGENIC AGENT; INTRODUCING SULFONYL GROUP ON HYDROXY GROUP OF TETRAHYDROFURAN RING, HYDROLYSIS, BLOCKING, OXIDATION, WITTING REACTION, DEPROTECTION AND PHOSPHORYLATION | YAMASA CORPORATION (JP) | 1998-09-22 | — | — | US | disclosed |
| EP-0770621-A1 | 2'-DEOXY-2'-(SUBSTITUTED OR UNSUBSTITUTED METHYLIDENE)-4'-THIONUCLEOSIDE | YAMASA CORPORATION (JP) | 1997-05-02 | — | — | EP | disclosed |