Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 6/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.50 |
| ▸ | MEN1 | O00255 | 3/20 | 0.50 |
| ▸ | ESR1 | P03372 | 2/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.41 |
| ▸ | HPGD | P15428 | 3/20 | 0.40 |
| ▸ | GAA | P10253 | 2/20 | 0.38 |
| ▸ | CASP1 | P29466 | 2/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | GLA | P06280 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | CASP7 | P55210 | 1/20 | 0.38 |
| ▸ | MMP2 | P08253 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 2/20 | 0.38 |
| ▸ | GPR3 | P46089 | 1/20 | 0.38 |
| ▸ | MYLK | Q15746 | 1/20 | 0.37 |
| ▸ | NPC1 | O15118 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | ADORA3 | P0DMS8 | 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 | |
|---|---|---|---|---|
| SCHEMBL20537230 | 0.78 | RAB9A (0.51) | KDM4EKMT2AMEN1ESR1ALDH1A1 | |
| SCHEMBL27991790 | 0.74 | KMT2A (0.46) | KDM4EKMT2AMEN1ESR1ALDH1A1 | |
| SCHEMBL19854406 | 0.71 | ALDH1A1 (0.49) | KDM4EKMT2AMEN1ALDH1A1HPGD | |
| SCHEMBL29053452 | 0.71 | MEN1 (0.50) | KDM4EKMT2AMEN1ALDH1A1HPGD | |
| SCHEMBL6974773 | 0.70 | GPR3 (0.60) | KDM4EKMT2AMEN1ALDH1A1HPGD | |
| SCHEMBL5311833 | 0.70 | PDGFRB (0.61) | KDM4EKMT2AMEN1LMNA | |
| SCHEMBL5804657 | 0.68 | KDM4E (0.46) | KDM4EKMT2AMEN1ALDH1A1HPGD | |
| SCHEMBL68922 | 0.68 | KDM4E (0.46) | KDM4EKMT2AMEN1ALDH1A1HPGD | |
| SCHEMBL18648461 | 0.68 | KDM4E (0.46) | KDM4EKMT2AMEN1ALDH1A1HPGD | |
| Hydrochloric Acid SCHEMBL27740780 | 0.68 | GPR3 (0.58) | KDM4EKMT2AMEN1ALDH1A1HPGD |
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-113646173-A | Layer structure with 3D structure and 2D projection of said structure | 科思创知识产权两合公司 | 2021-11-12 | — | — | CN | disclosed |