Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOS3 | P29474 | 1/20 | 0.31 |
| ▸ | NOS1 | P29475 | 1/20 | 0.31 |
| ▸ | NOS2 | P35228 | 1/20 | 0.31 |
| ▸ | CDK2 | P24941 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | PI4KA | P42356 | 1/20 | 0.30 |
| ▸ | PI4K2B | Q8TCG2 | 1/20 | 0.30 |
| ▸ | PI4K2A | Q9BTU6 | 1/20 | 0.30 |
| ▸ | PI4KB | Q9UBF8 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL16740281 | 0.72 | HTT (0.56) | ALDH1A1 | |
| SCHEMBL16740035 | 0.68 | TLR8 (0.38) | CDK2ALDH1A1 | |
| SCHEMBL14301805 | 0.68 | CYP1A2 (0.44) | ALDH1A1 | |
| SCHEMBL16740367 | 0.67 | CDC7 (0.36) | CDK2ALDH1A1 | |
| SCHEMBL28566639 | 0.65 | CLK4 (0.42) | NOS3NOS1NOS2ALDH1A1 | |
| SCHEMBL6643409 | 0.65 | NOS2 (0.41) | NOS3NOS1NOS2ALDH1A1 | |
| SCHEMBL3294049 | 0.64 | KMT2A (0.35) | ALDH1A1 | |
| SCHEMBL16682229 | 0.60 | BACE1 (0.40) | PI4KAPI4KB | |
| SCHEMBL30241135 | 0.60 | PTGDR2 (0.40) | ALDH1A1 | |
| SCHEMBL3291513 | 0.60 | TLR8 (0.36) | — |
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-3071553-A1 | SUBSTITUTED PYRIDINE AND PYRAZINE BMI-1 INHIBITORS | PTC Therapeutics, Inc. (US) | 2016-09-28 | — | — | EP | disclosed |
| WO-2015076800-A1 | SUBSTITUTED PYRIDINE AND PYRAZINE BMI-1 INHIBITORS | PTC THERAPEUTICS, INC. (US) | 2015-05-28 | — | — | WO | disclosed |