Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MPO | P05164 | 1/20 | 0.46 |
| ▸ | TPO | P07202 | 1/20 | 0.46 |
| ▸ | TLR7 | Q9NYK1 | 2/20 | 0.39 |
| ▸ | CDK2 | P24941 | 4/20 | 0.38 |
| ▸ | CDK1 | P06493 | 3/20 | 0.38 |
| ▸ | CCNB1 | P14635 | 3/20 | 0.38 |
| ▸ | CCNA2 | P20248 | 3/20 | 0.38 |
| ▸ | CCNA1 | P78396 | 3/20 | 0.38 |
| ▸ | CTSD | P07339 | 1/20 | 0.38 |
| ▸ | CCNB2 | O95067 | 1/20 | 0.37 |
| ▸ | MAPK3 | P27361 | 1/20 | 0.37 |
| ▸ | CLK1 | P49759 | 1/20 | 0.37 |
| ▸ | CDK5 | Q00535 | 1/20 | 0.37 |
| ▸ | PIN1 | Q13526 | 1/20 | 0.37 |
| ▸ | CCNB3 | Q8WWL7 | 1/20 | 0.37 |
| ▸ | MAP3K5 | Q99683 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | TSHR | P16473 | 2/20 | 0.36 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.35 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL6273507 | 0.85 | MPO (0.52) | MPOTPOCDK2CDK1CCNB1 | |
| SCHEMBL17186334 | 0.83 | CDK2 (0.46) | CDK2CDK1CCNB1CCNA2CCNA1 | |
| SCHEMBL17186421 | 0.83 | CDK2 (0.43) | CDK2CDK1CCNB1CCNA2CCNA1 | |
| SCHEMBL17186252 | 0.82 | CDK2 (0.51) | CDK2CDK1CCNB1CCNA2CCNA1 | |
| Hydrochloric Acid SCHEMBL18605794 | 0.82 | CDK2 (0.46) | TLR7CDK2CDK1CCNB1CCNA2 | |
| Hydrochloric Acid SCHEMBL17186437 | 0.82 | CDK2 (0.48) | CDK2CDK1CCNB1CCNA2CCNA1 | |
| Hydrochloric Acid SCHEMBL18605843 | 0.82 | CDK2 (0.42) | TLR7CDK2CDK1CCNB1CCNA2 | |
| SCHEMBL6273285 | 0.82 | MPO (0.41) | MPOTPOTLR7CTSDALDH1A1 | |
| Hydrochloric Acid SCHEMBL17186345 | 0.81 | CDK2 (0.50) | CDK2CDK1CCNB1CCNA2CCNA1 | |
| SCHEMBL17186383 | 0.76 | TLR9 (0.41) | TLR7ALDH1A1TSHRCHEK1PNP |
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-1017394-B1 | CYCLIN DEPENDENT KINASE INHIBITING PURINE DERIVATIVES | CANCER REC TECH LTD (GB) | 2005-12-07 | — | — | EP | disclosed |
| US-6303618-B1 | ADMINISTERING PURINE COMPOUND WHICH INHIBITS CYCLIC DEPENDENT KINASE ACTIVITY FOR THERAPY OF TUMOR OR OTHER CELL PROLIFERATION DISORDER | CANCER RESEARCH CAMPAIGN TECHNOLOGY LIMITED (GB) | 2001-10-16 | — | — | US | disclosed |