Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 5/20 | 0.57 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.57 |
| ▸ | RAB9A | P51151 | 4/20 | 0.57 |
| ▸ | NPC1 | O15118 | 3/20 | 0.57 |
| ▸ | S1PR3 | Q99500 | 1/20 | 0.56 |
| ▸ | LMNA | P02545 | 3/20 | 0.53 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.53 |
| ▸ | POLB | P06746 | 1/20 | 0.53 |
| ▸ | FPR2 | P25090 | 2/20 | 0.51 |
| ▸ | TSHR | P16473 | 1/20 | 0.50 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.50 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.50 |
| ▸ | RELA | Q04206 | 1/20 | 0.50 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.50 |
| ▸ | MAPT | P10636 | 1/20 | 0.50 |
| ▸ | MAOA | P21397 | 1/20 | 0.50 |
| ▸ | MAOB | P27338 | 1/20 | 0.50 |
| ▸ | FPR1 | P21462 | 1/20 | 0.49 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL28575872 | 1.00 | MEN1 (0.57) | MEN1KMT2ARAB9ANPC1S1PR3 | |
| SCHEMBL28589184 | 1.00 | MEN1 (0.57) | MEN1KMT2ARAB9ANPC1S1PR3 | |
| SCHEMBL12805040 | 0.86 | MEN1 (0.61) | MEN1KMT2ARAB9ANPC1S1PR3 | |
| SCHEMBL3868208 | 0.84 | MEN1 (0.57) | MEN1KMT2ARAB9ANPC1S1PR3 | |
| SCHEMBL1751197 | 0.83 | MEN1 (0.53) | MEN1KMT2ARAB9ANPC1S1PR3 | |
| SCHEMBL1748983 | 0.82 | TAAR1 (0.64) | MEN1KMT2ARAB9ANPC1S1PR3 | |
| SCHEMBL30729658 | 0.82 | MAPT (0.69) | KMT2ARAB9ANPC1LMNASMN1; SMN2 | |
| SCHEMBL28581175 | 0.80 | MEN1 (0.57) | MEN1KMT2ARAB9ANPC1LMNA | |
| SCHEMBL28589171 | 0.80 | MEN1 (0.57) | MEN1KMT2ARAB9ANPC1LMNA | |
| SCHEMBL7086042 | 0.80 | MEN1 (0.57) | MEN1KMT2ARAB9ANPC1LMNA |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-112778154-B | Aryl alkyl ether compound and derivative thereof, preparation method, pharmaceutical composition and application | 中国药科大学 | 2022-05-13 | — | — | CN | disclosed |
| CN-112778154-A | Aryl alkyl ether compound and derivative thereof, preparation method, pharmaceutical composition and application | 中国药科大学 | 2021-05-11 | — | — | CN | disclosed |