Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SCN4A | P35499 | 7/20 | 0.49 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.41 |
| ▸ | TACR1 | P25103 | 1/20 | 0.39 |
| ▸ | IDO1 | P14902 | 2/20 | 0.38 |
| ▸ | TDO2 | P48775 | 2/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.37 |
| ▸ | MEN1 | O00255 | 2/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.37 |
| ▸ | LMNA | P02545 | 3/20 | 0.36 |
| ▸ | TSHR | P16473 | 2/20 | 0.36 |
| ▸ | TP53 | P04637 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.35 |
| ▸ | GABBR2 | O75899 | 3/20 | 0.35 |
| ▸ | GABBR1 | Q9UBS5 | 3/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL10780233 | 0.81 | IDO1 (0.38) | SCN4ATACR1IDO1TDO2CYP2D6 | |
| SCHEMBL5462262 | 0.75 | SCN4A (0.53) | SCN4AADRB2TACR1IDO1TDO2 | |
| SCHEMBL5460859 | 0.75 | SCN4A (0.53) | SCN4AADRB2TACR1IDO1TDO2 | |
| SCHEMBL2398305 | 0.69 | SCN4A (0.73) | SCN4ACYP2C9CYP2D6LMNATSHR | |
| SCHEMBL7646258 | 0.69 | ADRB2 (0.39) | SCN4AADRB2CYP2C9MEN1CYP2D6 | |
| SCHEMBL14142191 | 0.69 | ADRB2 (0.52) | SCN4AADRB2IDO1TDO2CYP2C9 | |
| SCHEMBL1953110 | 0.69 | ADRB2 (0.52) | SCN4AADRB2CYP2C9MEN1CYP2D6 | |
| SCHEMBL6032624 | 0.68 | GABBR2 (0.64) | SCN4AADRB2CYP2C9MEN1CYP2D6 | |
| SCHEMBL12846320 | 0.68 | SCN4A (0.50) | SCN4AADRB2TACR1IDO1TDO2 | |
| SCHEMBL11474249 | 0.68 | CNR1 (0.41) | IDO1TDO2CYP2C9MEN1CYP2D6 |
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-106892942-B | A kind of preparation method of beta-amido ethylphosphonic acid derivative | 苏州大学 | 2019-01-04 | — | — | CN | disclosed |
| CN-105017312-A | Preparation method of beta-aminoethyl phosphono derivative | UNIV SOOCHOW | 2015-11-04 | — | — | CN | disclosed |