Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.56 |
| ▸ | CYP4F2 | P78329 | 1/20 | 0.43 |
| ▸ | CYP4A11 | Q02928 | 1/20 | 0.43 |
| ▸ | GABRA5 | P31644 | 2/20 | 0.43 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.43 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.43 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.43 |
| ▸ | GABRA3 | P34903 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.43 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 2/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
| ▸ | ATM | Q13315 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL25551932 | 1.00 | ALDH1A1 (0.56) | ALDH1A1CYP4F2CYP4A11GABRA5GABRA1 | |
| SCHEMBL25551910 | 0.86 | ALDH1A1 (0.56) | ALDH1A1CYP4F2CYP4A11GABRA5GABRA1 | |
| SCHEMBL30037572 | 0.80 | ALDH1A1 (0.49) | ALDH1A1CYP4F2CYP4A11GABRA5GABRA1 | |
| SCHEMBL25551926 | 0.80 | ALDH1A1 (0.49) | ALDH1A1CYP4F2CYP4A11GABRA5GABRA1 | |
| SCHEMBL24572726 | 0.80 | ALDH1A1 (0.61) | ALDH1A1CYP4F2CYP4A11GABRA5GABRA1 | |
| SCHEMBL2831583 | 0.80 | ALDH1A1 (0.61) | ALDH1A1CYP4F2CYP4A11GABRA5GABRA1 | |
| SCHEMBL25551995 | 0.79 | ALDH1A1 (0.60) | ALDH1A1CYP4F2CYP4A11GABRA5GABRA1 | |
| SCHEMBL25551905 | 0.79 | ALDH1A1 (0.60) | ALDH1A1CYP4F2CYP4A11GABRA5GABRA1 | |
| SCHEMBL25551937 | 0.78 | CKS1B (0.49) | ALDH1A1GABRA5LMNAGAAMEN1 | |
| SCHEMBL30036979 | 0.78 | CKS1B (0.49) | ALDH1A1GABRA5LMNAGAAMEN1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-115515940-A | Inhibitors of receptor interacting protein kinase I for the treatment of disease | 德州大学系统董事会 | 2022-12-23 | — | — | CN | disclosed |