Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 1/20 | 0.46 |
| ▸ | HTR2A | P28223 | 1/20 | 0.43 |
| ▸ | TAAR1 | Q96RJ0 | 2/20 | 0.41 |
| ▸ | HMGCR | P04035 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | ACHE | P22303 | 1/20 | 0.36 |
| ▸ | DHFR | P00374 | 1/20 | 0.36 |
| ▸ | TUBB1 | Q9H4B7 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 2/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | CA9 | Q16790 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL9886154 | 0.89 | PTGS2 (0.42) | PTGS2HTR2ATAAR1TUBB1 | |
| SCHEMBL18304159 | 0.86 | PTGS2 (0.39) | PTGS2HTR2ATAAR1DHFRTUBB1 | |
| SCHEMBL15715518 | 0.86 | HTR2A (0.48) | PTGS2HTR2ATAAR1SMN1; SMN2MAPT | |
| SCHEMBL12325395 | 0.80 | PTGS2 (0.44) | PTGS2HTR2ATAAR1ACHEDHFR | |
| SCHEMBL10599722 | 0.79 | MAPT (0.38) | PTGS2HTR2AKDM4ESMN1; SMN2ACHE | |
| SCHEMBL12885657 | 0.78 | ACHE (0.48) | PTGS2HTR2ATAAR1KDM4ESMN1; SMN2 | |
| SCHEMBL21547605 | 0.78 | PTGS2 (0.60) | PTGS2HTR2ATAAR1DHFRTUBB1 | |
| SCHEMBL2945602 | 0.78 | ALDH1A1 (0.48) | PTGS2HTR2ATAAR1KDM4ESMN1; SMN2 | |
| SCHEMBL26545151 | 0.77 | DHFR (0.34) | PTGS2HTR2ADHFR | |
| SCHEMBL6736591 | 0.76 | HSD17B10 (0.42) | PTGS2TAAR1DHFRMAPT |
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 |
|---|---|---|---|---|---|---|---|
| EP-2616513-B1 | CATALYSTS AND METHODS FOR POLYMER SYNTHESIS | SAUDI ARAMCO TECH CO (SA) | 2019-11-06 | — | — | EP | disclosed |