Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.54 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.54 |
| ▸ | HPGD | P15428 | 4/20 | 0.54 |
| ▸ | HSD17B1 | P14061 | 1/20 | 0.43 |
| ▸ | GLA | P06280 | 1/20 | 0.42 |
| ▸ | GAA | P10253 | 1/20 | 0.42 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | BRD4 | O60885 | 2/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | USP2 | O75604 | 1/20 | 0.38 |
| ▸ | S100A4 | P26447 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | TUBB4A | P04350 | 1/20 | 0.38 |
| ▸ | TUBB | P07437 | 1/20 | 0.38 |
| ▸ | TUBA3C | P0DPH7 | 1/20 | 0.38 |
| ▸ | TUBA1B | P68363 | 1/20 | 0.38 |
| ▸ | TUBA4A | P68366 | 1/20 | 0.38 |
| ▸ | TUBB4B | P68371 | 1/20 | 0.38 |
| ▸ | TUBB3 | Q13509 | 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 | |
|---|---|---|---|---|
| SCHEMBL6119284 | 1.00 | ALDH1A1 (0.54) | ALDH1A1KDM4EHPGDHSD17B1GLA | |
| SCHEMBL23335828 | 1.00 | ALDH1A1 (0.54) | ALDH1A1KDM4EHPGDHSD17B1GLA | |
| SCHEMBL14053635 | 0.97 | KDM4E (0.54) | ALDH1A1KDM4EHPGDHSD17B1GLA | |
| SCHEMBL23857698 | 0.90 | KDM4E (0.67) | ALDH1A1KDM4EHPGDHSD17B1GLA | |
| SCHEMBL6112770 | 0.81 | ALDH1A1 (0.81) | ALDH1A1KDM4EHPGDHSD17B1GLA | |
| SCHEMBL22560178 | 0.81 | ALDH1A1 (0.56) | ALDH1A1KDM4EHPGDHSD17B1GLA | |
| SCHEMBL1274675 | 0.81 | ALDH1A1 (0.81) | ALDH1A1KDM4EHPGDHSD17B1GLA | |
| SCHEMBL21715395 | 0.80 | ALDH1A1 (0.54) | ALDH1A1KDM4EHPGDHSD17B1GLA | |
| SCHEMBL6113134 | 0.80 | ALDH1A1 (0.54) | ALDH1A1KDM4EHPGDHSD17B1GLA | |
| SCHEMBL6113040 | 0.80 | ALDH1A1 (0.54) | ALDH1A1KDM4EHPGDHSD17B1GLA |
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 |
|---|---|---|---|---|---|---|---|
| EP-4051680-A1 | CONDENSED BI-HETEROCYCLES AS INHIBITING AGENTS FOR BRUTON'S TYROSINE KINASE | Biogen MA Inc. (US) | 2022-09-07 | — | — | EP | disclosed |