Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CRBN | Q96SW2 | 2/20 | 0.35 |
| ▸ | DDB1 | Q16531 | 1/20 | 0.35 |
| ▸ | RIPK1 | Q13546 | 2/20 | 0.33 |
| ▸ | ITGB3 | P05106 | 1/20 | 0.31 |
| ▸ | ITGA2B | P08514 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL16914102 | 0.81 | NAMPT (0.33) | CRBNDDB1 | |
| SCHEMBL16914466 | 0.81 | DDB1 (0.31) | CRBNDDB1 | |
| SCHEMBL5897345 | 0.79 | USP2 (0.30) | — | |
| SCHEMBL5895182 | 0.79 | CRBN (0.32) | CRBNDDB1RIPK1 | |
| SCHEMBL5895164 | 0.78 | FAAH (0.31) | — | |
| SCHEMBL5895416 | 0.75 | OPRM1 (0.33) | — | |
| SCHEMBL5896658 | 0.75 | CYP1A2 (0.39) | CRBN | |
| SCHEMBL20533530 | 0.74 | HSD11B1 (0.35) | CRBNDDB1RIPK1ITGB3ITGA2B | |
| SCHEMBL5896612 | 0.74 | ALDH1A1 (0.32) | — | |
| SCHEMBL20571915 | 0.73 | DDB1 (0.30) | CRBNDDB1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-3630770-A1 | PYRAZOLO[3,4-B]PYRAZINE DERIVATIVES AS SHP2 PHOSPHATASE INHIBITORS | Relay Therapeutics, Inc. (US) | 2020-04-08 | — | — | EP | disclosed |
| WO-2018218133-A1 | PYRAZOLO[3,4-B]PYRAZINE DERIVATIVES AS SHP2 PHOSPHATASE INHIBITORS | RELAY THERAPEUTICS, INC. (US) | 2018-11-29 | — | — | WO | disclosed |