Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP1 | P09874 | 1/20 | 0.47 |
| ▸ | HPRT1 | P00492 | 3/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 6/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.43 |
| ▸ | GLA | P06280 | 5/20 | 0.43 |
| ▸ | GAA | P10253 | 5/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.43 |
| ▸ | NPC1 | O15118 | 3/20 | 0.43 |
| ▸ | HPGD | P15428 | 3/20 | 0.43 |
| ▸ | CASP1 | P29466 | 1/20 | 0.43 |
| ▸ | CASP7 | P55210 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 2/20 | 0.41 |
| ▸ | RAB9A | P51151 | 2/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.41 |
| ▸ | TP53 | P04637 | 1/20 | 0.41 |
| ▸ | MAPK10 | P53779 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 2/20 | 0.41 |
| ▸ | MAPT | P10636 | 2/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL10062341 | 0.92 | KDM4E (0.47) | PARP1KDM4EALDH1A1GLAGAA | |
| SCHEMBL30966873 | 0.92 | KDM4E (0.47) | PARP1KDM4EALDH1A1GLAGAA | |
| SCHEMBL21419469 | 0.74 | KDM4E (0.58) | PARP1KDM4EALDH1A1GLAGAA | |
| SCHEMBL21656372 | 0.74 | RAB9A (0.40) | PARP1KDM4EALDH1A1GLAGAA | |
| SCHEMBL21622880 | 0.73 | KDM4E (0.53) | PARP1KDM4EALDH1A1GLAGAA | |
| SCHEMBL22940643 | 0.72 | KDM4E (0.49) | PARP1HPRT1KDM4EALDH1A1GLA | |
| SCHEMBL1650122 | 0.72 | KDM4E (0.41) | PARP1KDM4EALDH1A1GLAGAA | |
| SCHEMBL23917356 | 0.71 | KDM4E (0.36) | PARP1KDM4EALDH1A1GLAGAA | |
| SCHEMBL23917131 | 0.71 | KDM4E (0.37) | PARP1KDM4EALDH1A1GLAGAA | |
| SCHEMBL14929656 | 0.71 | TLR7 (0.49) | PARP1KDM4EALDH1A1GLAGAA |
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-2021125622-A1 | COMPOUND, ORGANIC ELECTROLUMINESCENT ELEMENT, AND DISPLAY DEVICE | 에스케이머티리얼즈 주식회사 | 2021-06-24 | — | — | WO | disclosed |