Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 3/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.50 |
| ▸ | TSHR | P16473 | 6/20 | 0.46 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.37 |
| ▸ | TP53 | P04637 | 2/20 | 0.37 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.37 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.36 |
| ▸ | THRB | P10828 | 1/20 | 0.35 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | APP | P05067 | 1/20 | 0.33 |
| ▸ | HTR2C | P28335 | 1/20 | 0.32 |
| ▸ | USP2 | O75604 | 1/20 | 0.31 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
| ▸ | CASP1 | P29466 | 1/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.31 |
| ▸ | SLCO1B3 | Q9NPD5 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL26756750 | 1.00 | MEN1 (0.50) | MEN1KMT2ATSHRMAPK1ALDH1A1 | |
| SCHEMBL23049683 | 1.00 | MEN1 (0.50) | MEN1KMT2ATSHRMAPK1ALDH1A1 | |
| SCHEMBL31576789 | 1.00 | MEN1 (0.50) | MEN1KMT2ATSHRMAPK1ALDH1A1 | |
| SCHEMBL22689123 | 0.91 | TSHR (0.42) | MEN1KMT2ATSHRALDH1A1TP53 | |
| SCHEMBL12275693 | 0.91 | TSHR (0.42) | MEN1KMT2ATSHRALDH1A1TP53 | |
| SCHEMBL625293 | 0.85 | — | — | |
| SCHEMBL18274688 | 0.84 | ALDH1A1 (0.38) | TSHRALDH1A1TP53HIF1AHSD17B10 | |
| SCHEMBL27639763 | 0.83 | — | — | |
| SCHEMBL1767665 | 0.83 | — | — | |
| Hydrochloric Acid SCHEMBL27956472 | 0.83 | — | — |
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-107469089-B | PEG connector and aglucon drug conjugate | 北京键凯科技股份有限公司 | 2022-01-07 | — | — | CN | disclosed |