Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTPN1 | P18031 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | DAO | P14920 | 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 | |
|---|---|---|---|---|
| SCHEMBL6622024 | 0.82 | L3MBTL1 (0.33) | DAO | |
| SCHEMBL7123204 | 0.82 | L3MBTL1 (0.33) | DAO | |
| SCHEMBL9742492 | 0.82 | IDO1 (0.39) | CYP2D6 | |
| SCHEMBL2961435 | 0.76 | UGT2B7 (0.38) | CYP1A2 | |
| SCHEMBL14354033 | 0.73 | HTR1B (0.38) | CYP1A2CYP2D6 | |
| SCHEMBL27666074 | 0.73 | GPR84 (0.32) | — | |
| SCHEMBL6612011 | 0.71 | KDM4E (0.33) | CYP1A2DAO | |
| SCHEMBL6622020 | 0.71 | KDM4E (0.33) | CYP1A2DAO | |
| SCHEMBL10919731 | 0.71 | KDM4E (0.36) | CYP1A2DAO | |
| SCHEMBL15780712 | 0.71 | CYP2A6 (0.35) | CYP1A2 |
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-106432214-B | A method of preparing ROMK channel inhibitor intermediate | 成都拿盛科技有限公司 | 2019-05-07 | — | — | CN | disclosed |