Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.37 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.36 |
| ▸ | CA12 | O43570 | 1/20 | 0.36 |
| ▸ | CA1 | P00915 | 1/20 | 0.36 |
| ▸ | IDO1 | P14902 | 1/20 | 0.36 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.36 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.36 |
| ▸ | CA9 | Q16790 | 1/20 | 0.36 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.36 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.36 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.36 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL28699449 | 0.70 | EPHX2 (0.40) | POLBCYP2C9CYP3A4CYP2C19NPSR1 | |
| SCHEMBL19272562 | 0.70 | MEN1 (0.43) | NPSR1LMNASMN1; SMN2HDAC3CA12 | |
| SCHEMBL28849403 | 0.70 | CYP1A2 (0.62) | CYP2C19SMN1; SMN2HDAC3CA1HDAC1 | |
| SCHEMBL28551769 | 0.70 | CYP1A2 (0.41) | CYP2C19SMN1; SMN2HDAC3CA1ALOX15 | |
| SCHEMBL28536195 | 0.70 | CYP1A2 (0.41) | CYP2C19SMN1; SMN2HDAC3CA1ALOX15 | |
| SCHEMBL19272539 | 0.69 | KMT2A (0.52) | CYP3A4LMNAHDAC1HDAC2HDAC8 | |
| SCHEMBL28849391 | 0.69 | CYP1A2 (0.61) | CYP2C19SMN1; SMN2HDAC3CA1HDAC1 | |
| SCHEMBL28250190 | 0.68 | POLB (0.54) | POLBCYP2C9CYP3A4CYP2C19NPSR1 | |
| SCHEMBL3039120 | 0.68 | POLB (0.58) | POLBCYP2C9CYP3A4CYP2C19NPSR1 | |
| SCHEMBL28250046 | 0.68 | POLB (0.49) | POLBCYP2C9CYP3A4CYP2C19NPSR1 |
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-112321467-A | Preparation method of (2S,3R) -p-methylsulfonylphenylserine ethyl ester | 苏州开元民生科技股份有限公司 | 2021-02-05 | — | — | CN | disclosed |