Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GBA1 | P04062 | 13/20 | 0.51 |
| ▸ | ROS1 | P08922 | 3/20 | 0.42 |
| ▸ | USP2 | O75604 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | ABL1 | P00519 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL20710491 | 1.00 | GBA1 (0.51) | GBA1ROS1USP2ALDH1A1ABL1 | |
| SCHEMBL20710493 | 0.95 | GBA1 (0.52) | GBA1ROS1USP2ALDH1A1 | |
| SCHEMBL20710490 | 0.93 | GBA1 (0.54) | GBA1ROS1USP2ALDH1A1 | |
| SCHEMBL20710429 | 0.88 | GBA1 (0.51) | GBA1USP2ALDH1A1 | |
| SCHEMBL20710424 | 0.84 | GBA1 (0.54) | GBA1ROS1ALDH1A1 | |
| SCHEMBL28895049 | 0.84 | ROS1 (0.44) | GBA1ROS1ABL1 | |
| SCHEMBL28895045 | 0.84 | ROS1 (0.44) | GBA1ROS1ABL1 | |
| SCHEMBL30085410 | 0.84 | ROS1 (0.44) | GBA1ROS1ABL1 | |
| SCHEMBL22403212 | 0.79 | GBA1 (0.52) | GBA1USP2ALDH1A1 | |
| SCHEMBL20710506 | 0.79 | GBA1 (0.65) | GBA1USP2ALDH1A1 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2019027765-A1 | SUBSTITUTED FUSED PYRIMIDINE COMPOUNDS AND USES THERE | NORTHWESTERN UNIVERSITY (US) | 2019-02-07 | — | — | WO | disclosed |