Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RPS6KA5 | O75582 | 2/20 | 0.50 |
| ▸ | CDC7 | O00311 | 9/20 | 0.40 |
| ▸ | CDK2 | P24941 | 7/20 | 0.40 |
| ▸ | TRPV1 | Q8NER1 | 3/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | CTDSP1 | Q9GZU7 | 1/20 | 0.38 |
| ▸ | ROCK1 | Q13464 | 5/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL19100158 | 0.85 | RPS6KA5 (0.52) | RPS6KA5CDC7CDK2TRPV1KDM4E | |
| SCHEMBL28603801 | 0.83 | RPS6KA5 (0.48) | RPS6KA5CDC7CDK2TRPV1KDM4E | |
| SCHEMBL19100174 | 0.82 | RPS6KA5 (0.50) | RPS6KA5CDC7CDK2TRPV1KDM4E | |
| SCHEMBL30467968 | 0.82 | RPS6KA5 (0.50) | RPS6KA5CDC7CDK2KDM4EPOLB | |
| SCHEMBL17339100 | 0.82 | RPS6KA5 (0.50) | RPS6KA5CDC7CDK2KDM4EPOLB | |
| SCHEMBL18803532 | 0.82 | RPS6KA5 (0.54) | RPS6KA5CDC7CDK2KDM4EPOLB | |
| SCHEMBL28600569 | 0.82 | RPS6KA5 (0.50) | RPS6KA5CDC7CDK2KDM4EPOLB | |
| SCHEMBL19100655 | 0.82 | RPS6KA5 (0.47) | RPS6KA5CDC7CDK2TRPV1KDM4E | |
| SCHEMBL19100635 | 0.79 | ALDH1A1 (0.49) | RPS6KA5CDC7CDK2KDM4EPOLB | |
| SCHEMBL19100558 | 0.79 | RPS6KA5 (0.47) | RPS6KA5CDC7CDK2KDM4EPOLB |
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 |
|---|---|---|---|---|---|---|---|
| CN-109328059-B | Selective inhibitors of clinically important mutants of EGFR tyrosine kinase | CS制药技术有限公司 | 2021-08-17 | — | — | CN | disclosed |
| CN-109328059-A | Selective inhibitors of clinically important mutants of EGFR tyrosine kinase | CS制药技术有限公司 | 2019-02-12 | — | — | CN | disclosed |