Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | JAK2 | O60674 | 1/20 | 0.39 |
| ▸ | TNIK | Q9UKE5 | 1/20 | 0.37 |
| ▸ | TGFBR1 | P36897 | 12/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | MAPK14 | Q16539 | 6/20 | 0.34 |
| ▸ | USP2 | O75604 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | CASP1 | P29466 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | MET | P08581 | 1/20 | 0.33 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.32 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL30305529 | 1.00 | JAK2 (0.39) | JAK2TNIKTGFBR1MAPTMAPK14 | |
| SCHEMBL23985120 | 0.93 | TNIK (0.39) | JAK2TNIKTGFBR1MAPTMAPK14 | |
| SCHEMBL30305463 | 0.93 | TNIK (0.39) | JAK2TNIKTGFBR1MAPTMAPK14 | |
| SCHEMBL30305407 | 0.87 | JAK2 (0.42) | JAK2TNIKTGFBR1MAPTALDH1A1 | |
| SCHEMBL23985261 | 0.87 | JAK2 (0.42) | JAK2TNIKTGFBR1MAPTALDH1A1 | |
| SCHEMBL23985112 | 0.85 | TGFBR1 (0.37) | JAK2TGFBR1MAPK14ALDH1A1CYP1A2 | |
| SCHEMBL30305424 | 0.85 | TGFBR1 (0.37) | JAK2TGFBR1MAPK14ALDH1A1CYP1A2 | |
| SCHEMBL25408630 | 0.82 | MAPT (0.41) | MAPTALDH1A1 | |
| SCHEMBL30451063 | 0.82 | ALDH1A1 (0.40) | MAPTALDH1A1HSD17B10 | |
| SCHEMBL23985116 | 0.82 | MAPT (0.35) | TGFBR1MAPTMAPK14 |
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 |
| US-20230353959-A1 | PI3K-ALPHA INHIBITORS AND METHODS OF USE THEREOF | RELAY THERAPEUTICS, INC. | 2023-11-02 | — | — | US | disclosed |
| WO-2021222556-A1 | PI3K-α INHIBITORS AND METHODS OF USE THEREOF | RELAY THERAPEUTICS, INC. (US) | 2021-11-04 | — | — | WO | disclosed |