Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.70 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.56 |
| ▸ | MEN1 | O00255 | 3/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.50 |
| ▸ | POLB | P06746 | 2/20 | 0.48 |
| ▸ | ESR1 | P03372 | 2/20 | 0.48 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.45 |
| ▸ | CES2 | O00748 | 1/20 | 0.42 |
| ▸ | RORC | P51449 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 2/20 | 0.41 |
| ▸ | RECQL | P46063 | 1/20 | 0.41 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.40 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.40 |
| ▸ | PTGIR | P43119 | 1/20 | 0.40 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.40 |
| ▸ | PDK1 | Q15118 | 1/20 | 0.40 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.40 |
| ▸ | PDK4 | Q16654 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 2/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL9509046 | 0.90 | TSHR (0.73) | TSHRALDH1A1MEN1KMT2APOLB | |
| SCHEMBL6909358 | 0.79 | KMT2A (0.48) | TSHRALDH1A1MEN1KMT2APOLB | |
| SCHEMBL3661402 | 0.79 | ALDH1A1 (0.60) | TSHRALDH1A1MEN1KMT2APOLB | |
| SCHEMBL4565670 | 0.78 | TSHR (0.57) | TSHRALDH1A1MEN1KMT2APOLB | |
| SCHEMBL10326109 | 0.77 | TSHR (0.46) | TSHRALDH1A1MEN1KMT2APOLB | |
| SCHEMBL9307563 | 0.77 | TSHR (0.42) | TSHRALDH1A1MEN1KMT2APOLB | |
| SCHEMBL7623744 | 0.76 | ALDH1A1 (0.57) | TSHRALDH1A1MEN1KMT2APOLB | |
| SCHEMBL7751622 | 0.75 | ADRA2C (0.56) | TSHRALDH1A1MEN1KMT2APOLB | |
| SCHEMBL176484 | 0.74 | TSHR (0.53) | TSHRALDH1A1MEN1KMT2APOLB | |
| SCHEMBL946547 | 0.74 | TSHR (0.53) | TSHRALDH1A1MEN1KMT2APOLB |
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-109134336-B | Diaryl ether compound, preparation method and application thereof | 北京大学深圳研究生院 | 2021-08-03 | — | — | CN | disclosed |