Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 3/20 | 0.37 |
| ▸ | RECQL | P46063 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 3/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | NPC1 | O15118 | 1/20 | 0.37 |
| ▸ | TP53 | P04637 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | THRB | P10828 | 1/20 | 0.37 |
| ▸ | HPGD | P15428 | 1/20 | 0.37 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.37 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.37 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.37 |
| ▸ | CASP1 | P29466 | 1/20 | 0.37 |
| ▸ | CASP3 | P42574 | 1/20 | 0.37 |
| ▸ | RAB9A | P51151 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL21608524 | 0.82 | SMN1; SMN2 (0.46) | SMN1; SMN2ALDH1A1TDP1LMNARECQL | |
| SCHEMBL22705062 | 0.81 | ADORA2A (0.35) | SMN1; SMN2ALDH1A1LMNAKDM4EADORA2A | |
| SCHEMBL5480468 | 0.79 | SMN1; SMN2 (0.63) | SMN1; SMN2ALDH1A1TDP1LMNARECQL | |
| SCHEMBL22704841 | 0.77 | SMN1; SMN2 (0.45) | SMN1; SMN2ALDH1A1TDP1LMNARECQL | |
| SCHEMBL30038840 | 0.76 | RECQL (0.43) | SMN1; SMN2ALDH1A1TDP1LMNARECQL | |
| SCHEMBL22704845 | 0.74 | SMN1; SMN2 (0.37) | SMN1; SMN2ALDH1A1TDP1LMNARECQL | |
| SCHEMBL5901433 | 0.71 | ADORA2A (0.38) | ALDH1A1LMNARECQLKDM4EHSD17B10 | |
| SCHEMBL7089917 | 0.71 | DPP4 (0.42) | ALDH1A1KDM4EMAPTADORA2AADORA1 | |
| SCHEMBL31541896 | 0.71 | C1S (0.39) | ALDH1A1LMNARECQLKDM4EMAPT | |
| SCHEMBL31286514 | 0.71 | ADORA2A (0.38) | ALDH1A1LMNARECQLKDM4EHSD17B10 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2020233592-A1 | HETEROCYCLIC COMPOUNDS, PREPARATION METHODS AND USES THEREOF | INVENTISBIO SHANGHAI LTD. (CN) | 2020-11-26 | — | — | WO | disclosed |