Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MRGPRX4 | Q96LA9 | 1/20 | 0.49 |
| ▸ | MEN1 | O00255 | 1/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.44 |
| ▸ | HPGD | P15428 | 1/20 | 0.44 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.44 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.42 |
| ▸ | TSHR | P16473 | 2/20 | 0.42 |
| ▸ | NPC1 | O15118 | 2/20 | 0.41 |
| ▸ | RAB9A | P51151 | 2/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | TP53 | P04637 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL29115879 | 1.00 | MRGPRX4 (0.49) | MRGPRX4MEN1CYP3A4HPGDALOX15 | |
| SCHEMBL29115752 | 0.82 | TSHR (0.50) | HIF1AKDM4EL3MBTL1TSHRNPC1 | |
| SCHEMBL30715284 | 0.82 | TSHR (0.50) | HIF1AKDM4EL3MBTL1TSHRNPC1 | |
| SCHEMBL29587881 | 0.77 | MRGPRX4 (0.43) | MRGPRX4MEN1CYP3A4HPGDALOX15 | |
| SCHEMBL10856105 | 0.73 | TSHR (0.50) | MRGPRX4MEN1CYP3A4HPGDALOX15 | |
| SCHEMBL22898020 | 0.73 | TSHR (0.50) | MRGPRX4MEN1CYP3A4HPGDALOX15 | |
| SCHEMBL7393468 | 0.72 | TSHR (0.54) | MRGPRX4MEN1CYP3A4HPGDALOX15 | |
| SCHEMBL23552455 | 0.71 | MRGPRX4 (0.54) | MRGPRX4MEN1CYP3A4HPGDALOX15 | |
| SCHEMBL1840532 | 0.71 | TSHR (0.62) | HIF1AKDM4EL3MBTL1TSHRNPC1 | |
| Catechol SCHEMBL10530180 | 0.71 | TSHR (0.75) | CYP3A4HPGDALOX15HIF1AHSD17B10 |
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-114478337-B | Axial chiral sulfur-containing diaryl derivative and synthesis method thereof | 安徽泽升科技有限公司上海分公司 | 2023-11-28 | — | — | CN | disclosed |