Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.46 |
| ▸ | MAPT | P10636 | 2/20 | 0.46 |
| ▸ | GAA | P10253 | 1/20 | 0.46 |
| ▸ | POLB | P06746 | 2/20 | 0.45 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.45 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.45 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.45 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.45 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.45 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.45 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.45 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.45 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.45 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.45 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.45 |
| ▸ | CASP7 | P55210 | 2/20 | 0.44 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.44 |
| ▸ | USP2 | O75604 | 1/20 | 0.44 |
| ▸ | CASP1 | P29466 | 1/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL29146098 | 0.89 | ALDH1A1 (0.49) | ALDH1A1MAPTGAAPOLBHDAC3 | |
| SCHEMBL8648212 | 0.79 | POLB (0.71) | ALDH1A1MAPTGAAPOLBHDAC3 | |
| SCHEMBL7327512 | 0.79 | NPC1 (0.63) | ALDH1A1MAPTNPSR1NPC1RAB9A | |
| SCHEMBL28469082 | 0.78 | ALDH1A1 (0.42) | ALDH1A1MAPTGAAPOLBALOX15 | |
| SCHEMBL4101149 | 0.76 | KMT2A (0.56) | ALDH1A1MAPTGAAPOLBHDAC3 | |
| SCHEMBL3281841 | 0.74 | HPGD (0.66) | ALDH1A1MAPTPOLBALOX15NPC1 | |
| SCHEMBL7333738 | 0.73 | LMNA (0.54) | ALDH1A1MAPTHSD17B10NPC1RAB9A | |
| SCHEMBL7326435 | 0.72 | RORC (0.52) | ALDH1A1MAPTCASP7CASP3CASP2 | |
| SCHEMBL11723468 | 0.72 | ESRRA (0.52) | ALDH1A1MAPTPOLBESRRAKMT2A | |
| SCHEMBL2910158 | 0.71 | BRD4 (0.45) | ALDH1A1POLBKMT2AMEN1MAPK1 |
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-111836801-B | Compounds for inhibiting TNIK and medical use thereof | 韩国化学硏究院 | 2024-02-02 | — | — | CN | disclosed |