Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMYD3 | Q9H7B4 | 1/20 | 0.33 |
| ▸ | NAAA | Q02083 | 2/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | F2 | P00734 | 1/20 | 0.32 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.32 |
| ▸ | PRSS2 | P07478 | 1/20 | 0.32 |
| ▸ | PRSS3 | P35030 | 1/20 | 0.32 |
| ▸ | ST14 | Q9Y5Y6 | 1/20 | 0.32 |
| ▸ | CYP19A1 | P11511 | 2/20 | 0.31 |
| ▸ | HTT | P42858 | 1/20 | 0.31 |
| ▸ | APOBEC3A | P31941 | 1/20 | 0.30 |
| ▸ | APOBEC3G | Q9HC16 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL27615579 | 0.92 | — | — | |
| SCHEMBL21357996 | 0.85 | NAAA (0.33) | NAAACYP2C19CYP19A1HTTAPOBEC3A | |
| SCHEMBL1593817 | 0.82 | CYP2C19 (0.49) | NAAACYP2C19CYP19A1HTT | |
| SCHEMBL17470137 | 0.82 | CYP2C19 (0.49) | NAAACYP2C19CYP19A1HTT | |
| SCHEMBL28953073 | 0.81 | NAAA (0.38) | SMYD3NAAACYP2C19F2PRSS1 | |
| SCHEMBL9176813 | 0.79 | CYP19A1 (0.43) | NAAACYP19A1HTTAPOBEC3AAPOBEC3G | |
| SCHEMBL9176800 | 0.79 | CYP19A1 (0.43) | NAAACYP19A1HTTAPOBEC3AAPOBEC3G | |
| SCHEMBL9176807 | 0.79 | CYP19A1 (0.43) | NAAACYP19A1HTTAPOBEC3AAPOBEC3G | |
| SCHEMBL9180685 | 0.76 | NAAA (0.37) | NAAACYP19A1HTTAPOBEC3AAPOBEC3G | |
| SCHEMBL9182507 | 0.76 | CYP19A1 (0.41) | NAAACYP19A1HTTAPOBEC3AAPOBEC3G |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-106565510-B | The preparation method of trans 4- Amino-cyclohexvls acetic ester derivative | 浙江京新药业股份有限公司 | 2018-04-27 | — | — | CN | disclosed |
| CN-106565510-A | Preparation method for trans 4-amino-cyclohexyl acetate derivative | 浙江京新药业股份有限公司 | 2017-04-19 | — | — | CN | disclosed |