Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNH2 | Q12809 | 1/20 | 0.35 |
| ▸ | CCNK | O75909 | 1/20 | 0.35 |
| ▸ | CCNA2 | P20248 | 1/20 | 0.35 |
| ▸ | CDK2 | P24941 | 1/20 | 0.35 |
| ▸ | CCND3 | P30281 | 1/20 | 0.35 |
| ▸ | CDK9 | P50750 | 1/20 | 0.35 |
| ▸ | CDK6 | Q00534 | 1/20 | 0.35 |
| ▸ | TRPV1 | Q8NER1 | 3/20 | 0.34 |
| ▸ | PARP1 | P09874 | 1/20 | 0.34 |
| ▸ | SQOR | Q9Y6N5 | 1/20 | 0.34 |
| ▸ | GPR119 | Q8TDV5 | 2/20 | 0.34 |
| ▸ | RET | P07949 | 1/20 | 0.33 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.33 |
| ▸ | NR1H3 | Q13133 | 1/20 | 0.33 |
| ▸ | GBA1 | P04062 | 1/20 | 0.33 |
| ▸ | CKS1B | P61024 | 1/20 | 0.33 |
| ▸ | SKP1 | P63208 | 1/20 | 0.33 |
| ▸ | SKP2 | Q13309 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | NSD2 | O96028 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL28655570 | 1.00 | KCNH2 (0.35) | KCNH2CCNKCCNA2CDK2CCND3 | |
| SCHEMBL30950272 | 0.92 | KCNH2 (0.36) | KCNH2CCNKCCNA2CDK2CCND3 | |
| SCHEMBL28929882 | 0.92 | KCNH2 (0.36) | KCNH2CCNKCCNA2CDK2CCND3 | |
| SCHEMBL28664682 | 0.91 | KCNH2 (0.36) | KCNH2SQORGPR119RETNR1H2 | |
| SCHEMBL30950196 | 0.91 | KCNH2 (0.36) | KCNH2SQORGPR119RETNR1H2 | |
| SCHEMBL28654715 | 0.90 | KCNH2 (0.35) | KCNH2CCNKCCNA2CDK2CCND3 | |
| SCHEMBL30950231 | 0.90 | KCNH2 (0.35) | KCNH2CCNKCCNA2CDK2CCND3 | |
| SCHEMBL30950243 | 0.89 | KRAS (0.38) | KCNH2CCNKCCNA2CDK2CCND3 | |
| SCHEMBL28673619 | 0.89 | KRAS (0.38) | KCNH2CCNKCCNA2CDK2CCND3 | |
| SCHEMBL30950264 | 0.88 | KRAS (0.42) | KCNH2PARP1SQORGPR119RET |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-113637005-B | KRAS inhibitors for cancer treatment | 泰励生物科技（上海）有限公司 | 2024-05-24 | — | — | CN | disclosed |