Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EPHX2 | P34913 | 1/20 | 0.33 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.33 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.33 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.32 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.31 |
| ▸ | USP2 | O75604 | 1/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.31 |
| ▸ | CCR2 | P41597 | 1/20 | 0.31 |
| ▸ | F13A1 | P00488 | 1/20 | 0.31 |
| ▸ | TGM2 | P21980 | 1/20 | 0.31 |
| ▸ | TGM1 | P22735 | 1/20 | 0.31 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL22108626 | 1.00 | EPHX2 (0.33) | EPHX2CHRM2CHRM1CHRM3HSD17B10 | |
| SCHEMBL704921 | 0.87 | NR1H2 (0.34) | EPHX2CHRM2CHRM1CHRM3HSD17B10 | |
| SCHEMBL16042147 | 0.87 | NR1H2 (0.34) | EPHX2CHRM2CHRM1CHRM3HSD17B10 | |
| SCHEMBL704922 | 0.87 | NR1H2 (0.34) | EPHX2CHRM2CHRM1CHRM3HSD17B10 | |
| SCHEMBL17924688 | 0.82 | CCR2 (0.31) | EPHX2CHRM2CHRM1CHRM3CCR2 | |
| SCHEMBL17924686 | 0.82 | CCR2 (0.31) | EPHX2CHRM2CHRM1CHRM3CCR2 | |
| SCHEMBL28202597 | 0.80 | CHRM2 (0.38) | EPHX2CHRM2CHRM1CHRM3HSD17B10 | |
| SCHEMBL12384278 | 0.80 | CHRM2 (0.35) | EPHX2CHRM2CHRM1CHRM3HSD17B10 | |
| SCHEMBL17924678 | 0.79 | EPHX2 (0.32) | EPHX2HDAC8CCR2 | |
| SCHEMBL17924769 | 0.79 | EPHX2 (0.32) | EPHX2HDAC8CCR2 |
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-113454058-A | Amino acid having functional group capable of forming intramolecular hydrogen bond, peptide compound comprising the same, and method for producing the same | 中外制药株式会社 | 2021-09-28 | — | — | CN | disclosed |