Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDK4 | P11802 | 20/20 | 0.67 |
| ▸ | CDK6 | Q00534 | 8/20 | 0.67 |
| ▸ | CDK12 | Q9NYV4 | 1/20 | 0.64 |
| ▸ | CCND1 | P24385 | 13/20 | 0.63 |
| ▸ | CCND3 | P30281 | 12/20 | 0.63 |
| ▸ | CCND2 | P30279 | 11/20 | 0.63 |
| ▸ | CDK2 | P24941 | 3/20 | 0.63 |
| ▸ | CCNA2 | P20248 | 2/20 | 0.63 |
| ▸ | CDK9 | P50750 | 2/20 | 0.63 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.59 |
| ▸ | DAPK3 | O43293 | 1/20 | 0.59 |
| ▸ | CCNT1 | O60563 | 1/20 | 0.59 |
| ▸ | CCNT2 | O60583 | 1/20 | 0.59 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.59 |
| ▸ | STK16 | O75716 | 1/20 | 0.59 |
| ▸ | CCNK | O75909 | 1/20 | 0.59 |
| ▸ | PDE5A | O76074 | 1/20 | 0.59 |
| ▸ | PRKD3 | O94806 | 1/20 | 0.59 |
| ▸ | CCNB2 | O95067 | 1/20 | 0.59 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.59 |
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 | |
|---|---|---|---|---|
| SCHEMBL29600291 | 0.96 | CDK4 (0.66) | CDK4CDK6CDK12CCND1CCND3 | |
| SCHEMBL2076205 | 0.96 | CDK4 (0.66) | CDK4CDK6CDK12CCND1CCND3 | |
| SCHEMBL2077623 | 0.95 | CDK4 (0.70) | CDK4CDK6CDK12CCND1CCND3 | |
| SCHEMBL4832945 | 0.94 | CDK4 (0.67) | CDK4CDK6CDK12CCND1CCND3 | |
| SCHEMBL29507410 | 0.90 | CDK4 (0.77) | CDK4CDK6CDK12CCND1CCND3 | |
| SCHEMBL4442470 | 0.90 | CDK4 (0.77) | CDK4CDK6CDK12CCND1CCND3 | |
| SCHEMBL30643549 | 0.90 | CDK4 (0.62) | CDK4CDK6CDK12CCND1CCND3 | |
| SCHEMBL17550859 | 0.89 | CDK4 (0.68) | CDK4CDK6CDK12CCND1CCND3 | |
| SCHEMBL17311359 | 0.89 | CDK4 (0.72) | CDK4CDK6CDK12CCND1CCND3 | |
| SCHEMBL29564471 | 0.89 | CDK4 (0.80) | CDK4CDK6CDK12CCND1CCND3 |
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 |
|---|---|---|---|---|---|---|---|
| CN-111892590-A | New piparib new intermediate, crystal form and preparation method thereof | 齐鲁制药有限公司 | 2020-11-06 | — | — | CN | claimed |
| CN-111892590-A | New piparib new intermediate, crystal form and preparation method thereof | 齐鲁制药有限公司 | 2020-11-06 | — | — | CN | disclosed |
| CN-111892590-A | New piparib new intermediate, crystal form and preparation method thereof | 齐鲁制药有限公司 | 2020-11-06 | — | — | CN | disclosed |