Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 1/20 | 0.44 |
| ▸ | HPGD | P15428 | 1/20 | 0.44 |
| ▸ | RAB9A | P51151 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
| ▸ | GPR3 | P46089 | 1/20 | 0.42 |
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.41 |
| ▸ | KIF11 | P52732 | 2/20 | 0.41 |
| ▸ | PTGIR | P43119 | 1/20 | 0.40 |
| ▸ | PMM2 | O15305 | 1/20 | 0.38 |
| ▸ | MPI | P34949 | 1/20 | 0.38 |
| ▸ | PHOSPHO1 | Q8TCT1 | 1/20 | 0.38 |
| ▸ | PRSS12 | P56730 | 1/20 | 0.38 |
| ▸ | CSNK1D | P48730 | 1/20 | 0.38 |
| ▸ | CSNK1G2 | P78368 | 1/20 | 0.38 |
| ▸ | APEX1 | P27695 | 1/20 | 0.38 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.38 |
| ▸ | TNKS | O95271 | 1/20 | 0.37 |
| ▸ | TNKS2 | Q9H2K2 | 1/20 | 0.37 |
| ▸ | PDGFRB | P09619 | 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 | |
|---|---|---|---|---|
| SCHEMBL23118205 | 0.91 | PTGIR (0.49) | MAPTGPR3ABCG2KIF11PTGIR | |
| SCHEMBL17283743 | 0.85 | GPR3 (0.58) | ALDH1A1MAPTHPGDRAB9ASMN1; SMN2 | |
| SCHEMBL25894375 | 0.84 | PTGIR (0.40) | ALDH1A1MAPTHPGDABCG2KIF11 | |
| SCHEMBL30961929 | 0.84 | GPR3 (0.52) | ALDH1A1MAPTHPGDRAB9ASMN1; SMN2 | |
| SCHEMBL15901763 | 0.84 | GPR3 (0.52) | ALDH1A1MAPTHPGDRAB9ASMN1; SMN2 | |
| SCHEMBL19801866 | 0.83 | HPGD (0.50) | ALDH1A1MAPTHPGDRAB9ASMN1; SMN2 | |
| SCHEMBL21086889 | 0.82 | ALDH1A1 (0.50) | ALDH1A1MAPTHPGDRAB9ASMN1; SMN2 | |
| SCHEMBL14617357 | 0.82 | GPR3 (0.54) | ALDH1A1MAPTHPGDRAB9ASMN1; SMN2 | |
| SCHEMBL26599434 | 0.81 | ABCG2 (0.37) | ALDH1A1MAPTHPGDRAB9ASMN1; SMN2 | |
| SCHEMBL30363442 | 0.81 | ABCG2 (0.37) | ALDH1A1MAPTHPGDRAB9ASMN1; SMN2 |
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-107698601-B | Heterocyclic compound and organic electroluminescent element comprising same | 株式会社LG化学 | 2022-01-04 | — | — | CN | disclosed |