Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RPS6KA5 | O75582 | 7/20 | 0.48 |
| ▸ | RPS6KA4 | O75676 | 1/20 | 0.48 |
| ▸ | MAPT | P10636 | 4/20 | 0.41 |
| ▸ | HPGD | P15428 | 4/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 3/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | RECQL | P46063 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 2/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | RORC | P51449 | 3/20 | 0.39 |
| ▸ | MKNK2 | Q9HBH9 | 2/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL28600611 | 0.92 | MAPT (0.40) | RPS6KA5RPS6KA4MAPTHPGDNPSR1 | |
| SCHEMBL28619153 | 0.84 | MAPT (0.42) | RPS6KA5MAPTHPGDNPSR1KDM4E | |
| SCHEMBL28603761 | 0.83 | RPS6KA5 (0.50) | RPS6KA5RPS6KA4MAPTHPGDNPSR1 | |
| SCHEMBL28605995 | 0.83 | RPS6KA5 (0.42) | RPS6KA5RPS6KA4MAPTHPGDNPSR1 | |
| SCHEMBL28605643 | 0.82 | RECQL (0.39) | RPS6KA5RPS6KA4MAPTHPGDNPSR1 | |
| SCHEMBL29651178 | 0.81 | RPS6KA5 (0.50) | RPS6KA5RPS6KA4KDM4ERECQLPOLB | |
| SCHEMBL28607415 | 0.81 | RPS6KA5 (0.50) | RPS6KA5RPS6KA4KDM4ERECQLPOLB | |
| SCHEMBL28603801 | 0.77 | RPS6KA5 (0.48) | RPS6KA5KDM4EALDH1A1CYP2C9CYP1A2 | |
| SCHEMBL31377998 | 0.76 | RPS6KA5 (0.46) | RPS6KA5RPS6KA4MAPTHPGDNPSR1 | |
| SCHEMBL29651144 | 0.76 | RPS6KA5 (0.46) | RPS6KA5RPS6KA4HPGDCYP2C9CYP1A2 |
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 |