Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HMGCR | P04035 | 1/20 | 0.44 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.44 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.44 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 2/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.37 |
| ▸ | FFAR3 | O14843 | 2/20 | 0.35 |
| ▸ | CPT2 | P23786 | 2/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | ACLY | P53396 | 3/20 | 0.32 |
| ▸ | HSPD1 | P10809 | 1/20 | 0.31 |
| ▸ | BLM | P54132 | 1/20 | 0.31 |
| ▸ | HSPE1 | P61604 | 1/20 | 0.31 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.31 |
| ▸ | HDAC1 | Q13547 | 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 | |
|---|---|---|---|---|
| SCHEMBL2421001 | 0.85 | HMGCR (0.52) | HMGCRCHRM1TBXA2RADRA1AALDH1A1 | |
| SCHEMBL380759 | 0.85 | HMGCR (0.52) | HMGCRCHRM1TBXA2RADRA1AALDH1A1 | |
| SCHEMBL380079 | 0.78 | HMGCR (0.46) | HMGCRCHRM1TBXA2RADRA1AALDH1A1 | |
| SCHEMBL9082665 | 0.76 | HMGCR (0.44) | HMGCRCHRM1TBXA2RADRA1AALDH1A1 | |
| SCHEMBL9618158 | 0.76 | — | — | |
| SCHEMBL8478589 | 0.76 | — | — | |
| SCHEMBL380973 | 0.75 | HMGCR (0.48) | HMGCRCHRM1TBXA2RADRA1AALDH1A1 | |
| SCHEMBL10940999 | 0.75 | HMGCR (0.48) | HMGCRCHRM1TBXA2RADRA1AALDH1A1 | |
| SCHEMBL28652055 | 0.74 | HMGCR (0.42) | HMGCRCHRM1TBXA2RADRA1AALDH1A1 | |
| SCHEMBL28485604 | 0.74 | ALDH1A1 (0.47) | HMGCRCHRM1TBXA2RADRA1AALDH1A1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-102605011-B | (S)-4-chloride-3-ethyl 3-hydroxybutyrate biological preparation method | SUZHOU ENZYMEWORKS BIOLOG TECHNOLOGY CO LTD | 2013-11-27 | — | — | CN | disclosed |
| CN-102605011-B | (S)-4-chloride-3-ethyl 3-hydroxybutyrate biological preparation method | SUZHOU ENZYMEWORKS BIOLOG TECHNOLOGY CO LTD | 2013-11-27 | — | — | CN | disclosed |
| CN-102605011-A | (S)-4-chloride-3-ethyl 3-hydroxybutyrate biological preparation method | SUZHOU ENZYMEWORKS BIOLOG TECHNOLOGY CO LTD | 2012-07-25 | — | — | CN | disclosed |
| CN-102605011-A | (S)-4-chloride-3-ethyl 3-hydroxybutyrate biological preparation method | SUZHOU ENZYMEWORKS BIOLOG TECHNOLOGY CO LTD | 2012-07-25 | — | — | CN | disclosed |