Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 3/20 | 0.47 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.47 |
| ▸ | ABL1 | P00519 | 1/20 | 0.47 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.47 |
| ▸ | BCR | P11274 | 1/20 | 0.47 |
| ▸ | HDAC4 | P56524 | 2/20 | 0.46 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.46 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.46 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.45 |
| ▸ | MAPT | P10636 | 2/20 | 0.44 |
| ▸ | NPC1 | O15118 | 1/20 | 0.44 |
| ▸ | TP53 | P04637 | 1/20 | 0.44 |
| ▸ | TSHR | P16473 | 1/20 | 0.44 |
| ▸ | RAB9A | P51151 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
| ▸ | STAT3 | P40763 | 1/20 | 0.43 |
| ▸ | BACE1 | P56817 | 2/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 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 | |
|---|---|---|---|---|
| SCHEMBL29055181 | 0.80 | PTGS2 (0.43) | PTGS2PTGS1MAPTNPC1TP53 | |
| SCHEMBL29055141 | 0.80 | PTGS2 (0.52) | PTGS2PTGS1SMN1; SMN2 | |
| SCHEMBL29055173 | 0.79 | PTGS2 (0.56) | PTGS2PTGS1RAB9AKDM4ECYP1A2 | |
| SCHEMBL29055172 | 0.79 | PTGS2 (0.56) | PTGS2PTGS1 | |
| SCHEMBL29055170 | 0.78 | BACE1 (0.45) | PTGS2PTGS1ABL1ABCB1BCR | |
| SCHEMBL29055155 | 0.76 | KIF11 (0.48) | PTGS2BACE1 | |
| SCHEMBL7624639 | 0.76 | HDAC4 (0.46) | PTGS2PTGS1ABL1ABCB1BCR | |
| SCHEMBL6725826 | 0.74 | PTGS2 (0.77) | PTGS2PTGS1ABL1ABCB1BCR | |
| SCHEMBL27550657 | 0.74 | PTGS2 (0.55) | PTGS2PTGS1ABL1ABCB1BCR | |
| SCHEMBL12715050 | 0.72 | ABL1 (0.79) | PTGS2ABL1ABCB1BCRHDAC4 |
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-116410116-A | Preparation method of m-terphenyl sulfoxide imine compound under rhodium catalysis | 赣南师范大学 | 2023-07-11 | — | — | CN | disclosed |