Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDK2 | P24941 | 15/20 | 0.78 |
| ▸ | CCNA2 | P20248 | 12/20 | 0.78 |
| ▸ | CDK4 | P11802 | 7/20 | 0.78 |
| ▸ | CCND3 | P30281 | 7/20 | 0.78 |
| ▸ | CDK6 | Q00534 | 7/20 | 0.78 |
| ▸ | CCNA1 | P78396 | 6/20 | 0.78 |
| ▸ | AURKA | O14965 | 6/20 | 0.77 |
| ▸ | PIM1 | P11309 | 1/20 | 0.69 |
| ▸ | TTK | P33981 | 1/20 | 0.69 |
| ▸ | PIM2 | Q9P1W9 | 1/20 | 0.69 |
| ▸ | PLK1 | P53350 | 7/20 | 0.61 |
| ▸ | PLK3 | Q9H4B4 | 3/20 | 0.61 |
| ▸ | PLK2 | Q9NYY3 | 2/20 | 0.61 |
| ▸ | RPS6KA4 | O75676 | 1/20 | 0.61 |
| ▸ | CDK1 | P06493 | 1/20 | 0.61 |
| ▸ | KIT | P10721 | 1/20 | 0.61 |
| ▸ | IMPDH2 | P12268 | 1/20 | 0.61 |
| ▸ | CCNB1 | P14635 | 1/20 | 0.61 |
| ▸ | CSNK2A2 | P19784 | 1/20 | 0.61 |
| ▸ | CCNE1 | P24864 | 1/20 | 0.61 |
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 | |
|---|---|---|---|---|
| SCHEMBL15385485 | 0.95 | TTK (0.77) | CDK2CCNA2CDK4CCND3CDK6 | |
| Hydrochloric Acid SCHEMBL12499339 | 0.94 | TTK (0.76) | CDK2CCNA2CDK4CCND3CDK6 | |
| SCHEMBL4162908 | 0.93 | CDK2 (0.77) | CDK2CCNA2CDK4CCND3CDK6 | |
| SCHEMBL4157095 | 0.89 | CDK2 (0.84) | CDK2CCNA2CDK4CCND3CDK6 | |
| SCHEMBL4164558 | 0.89 | CDK2 (0.84) | CDK2CCNA2CDK4CCND3CDK6 | |
| SCHEMBL4158648 | 0.88 | CDK2 (0.83) | CDK2CCNA2CDK4CCND3CDK6 | |
| SCHEMBL4150392 | 0.88 | CDK2 (0.83) | CDK2CCNA2CDK4CCND3CDK6 | |
| SCHEMBL4154687 | 0.88 | CDK2 (1.00) | CDK2CCNA2CDK4CCND3CDK6 | |
| SCHEMBL4171069 | 0.87 | CDK2 (0.69) | CDK2CCNA2CDK4CCND3CDK6 | |
| SCHEMBL4160066 | 0.87 | CDK2 (0.82) | CDK2CCNA2CDK4CCND3CDK6 |
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-9637497-B2 | Pyrazolo-quinazoline derivatives, process for their preparation and their use as kinase inhibitors | Nerviano Medical Sciences, S.R.L. (IT) | 2017-05-02 | — | — | US | disclosed |
| US-9637497-B2 | Pyrazolo-quinazoline derivatives, process for their preparation and their use as kinase inhibitors | Nerviano Medical Sciences, S.R.L. (IT) | 2017-05-02 | — | — | US | disclosed |