Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.76 |
| ▸ | ATM | Q13315 | 3/20 | 0.76 |
| ▸ | MAPT | P10636 | 2/20 | 0.76 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.76 |
| ▸ | MEN1 | O00255 | 2/20 | 0.76 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.76 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.76 |
| ▸ | POLB | P06746 | 1/20 | 0.76 |
| ▸ | HPGD | P15428 | 1/20 | 0.76 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.76 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.76 |
| ▸ | NPC1 | O15118 | 2/20 | 0.68 |
| ▸ | RAB9A | P51151 | 2/20 | 0.68 |
| ▸ | RPS6KA2 | Q15349 | 1/20 | 0.67 |
| ▸ | CASP3 | P42574 | 2/20 | 0.64 |
| ▸ | APAF1 | O14727 | 1/20 | 0.55 |
| ▸ | GAA | P10253 | 1/20 | 0.55 |
| ▸ | SENP8 | Q96LD8 | 1/20 | 0.55 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.55 |
| ▸ | SENP6 | Q9GZR1 | 1/20 | 0.55 |
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 | |
|---|---|---|---|---|
| SCHEMBL31667598 | 0.89 | KDM4E (0.67) | KDM4EATMMAPTMAPK1MEN1 | |
| SCHEMBL382311 | 0.85 | KDM4E (0.65) | KDM4EATMMAPTMAPK1MEN1 | |
| SCHEMBL30428778 | 0.85 | KDM4E (0.65) | KDM4EATMMAPTMAPK1MEN1 | |
| SCHEMBL20877391 | 0.85 | KDM4E (0.65) | KDM4EATMMAPTMAPK1MEN1 | |
| SCHEMBL45154 | 0.84 | CASP3 (0.88) | KDM4EMEN1KMT2ACASP3APAF1 | |
| SCHEMBL30296449 | 0.84 | CASP3 (0.88) | KDM4EMEN1KMT2ACASP3APAF1 | |
| SCHEMBL18688197 | 0.82 | MAPT (0.76) | KDM4EATMMAPTMAPK1MEN1 | |
| SCHEMBL30451193 | 0.81 | CA1 (0.67) | KDM4EATMMAPTMAPK1MEN1 | |
| SCHEMBL26712506 | 0.81 | CA1 (0.67) | KDM4EATMMAPTMAPK1MEN1 | |
| SCHEMBL23985873 | 0.80 | PARK7 (0.59) | KDM4EATMMAPTMAPK1MEN1 |
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 |
|---|---|---|---|---|---|---|---|
| US-20230353959-A1 | PI3K-ALPHA INHIBITORS AND METHODS OF USE THEREOF | RELAY THERAPEUTICS, INC. | 2023-11-02 | — | — | US | disclosed |
| CN-116261562-A | PI 3K-alpha inhibitors and methods of use thereof | 传达治疗有限公司 | 2023-06-13 | — | — | CN | disclosed |
| WO-2021222556-A1 | PI3K-α INHIBITORS AND METHODS OF USE THEREOF | RELAY THERAPEUTICS, INC. (US) | 2021-11-04 | — | — | WO | disclosed |