Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.39 |
| ▸ | MAPT | P10636 | 4/20 | 0.39 |
| ▸ | HPGD | P15428 | 4/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.39 |
| ▸ | TSHR | P16473 | 2/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.39 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.39 |
| ▸ | RELA | Q04206 | 1/20 | 0.39 |
| ▸ | ATM | Q13315 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | ADORA2A | P29274 | 2/20 | 0.36 |
| ▸ | ADORA1 | P30542 | 2/20 | 0.36 |
| ▸ | MEN1 | O00255 | 2/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.35 |
| ▸ | MPI | P34949 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL24520922 | 0.89 | ALDH1A1 (0.36) | ALDH1A1MAPTHPGDKDM4ETSHR | |
| SCHEMBL24521037 | 0.88 | MET (0.36) | ALDH1A1MAPTHPGDKDM4ETSHR | |
| SCHEMBL24521092 | 0.88 | ADORA2A (0.37) | ALDH1A1MAPTHPGDKDM4ETSHR | |
| SCHEMBL24521040 | 0.85 | MET (0.34) | ALDH1A1MAPTHPGDKDM4ETSHR | |
| SCHEMBL25035924 | 0.84 | MAPT (0.40) | ALDH1A1MAPTHPGDKDM4ETSHR | |
| SCHEMBL24521105 | 0.83 | MEN1 (0.39) | ALDH1A1MAPTHPGDKDM4ESMN1; SMN2 | |
| SCHEMBL24521098 | 0.83 | CYP1A1 (0.42) | ALDH1A1MAPTHPGDKDM4EMAPK1 | |
| SCHEMBL24521101 | 0.82 | MEN1 (0.39) | ALDH1A1MAPTHPGDKDM4ESMN1; SMN2 | |
| SCHEMBL24521004 | 0.82 | CYP1A2 (0.38) | ALDH1A1MAPTKDM4ETSHRMAPK1 | |
| SCHEMBL24521214 | 0.80 | KCNH2 (0.43) | ALDH1A1TSHRMAPK1HSD17B10TP53 |
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-4015515-A1 | HETEROCYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE COMPRISING SAME | LT Materials Co., Ltd. (KR) | 2022-06-22 | — | — | EP | disclosed |