Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNN4 | O15554 | 4/20 | 0.64 |
| ▸ | HTR2A | P28223 | 2/20 | 0.44 |
| ▸ | HTR2C | P28335 | 2/20 | 0.44 |
| ▸ | OPRK1 | P41145 | 2/20 | 0.44 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.44 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.44 |
| ▸ | KCNA3 | P22001 | 2/20 | 0.41 |
| ▸ | TSHR | P16473 | 4/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.40 |
| ▸ | MAPT | P10636 | 2/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
| ▸ | LMNA | P02545 | 2/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.40 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.40 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.40 |
| ▸ | CYP19A1 | P11511 | 2/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | SLC22A1 | O15245 | 1/20 | 0.40 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.40 |
| ▸ | GMNN | O75496 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL27459558 | 0.80 | KCNN4 (0.72) | KCNN4HTR2AHTR2COPRK1KCNH2 | |
| SCHEMBL18827503 | 0.78 | KCNN4 (0.57) | KCNN4HTR2AHTR2COPRK1KCNH2 | |
| SCHEMBL1001586 | 0.78 | KCNN4 (1.00) | KCNN4HTR2AHTR2COPRK1KCNH2 | |
| SCHEMBL9577804 | 0.78 | KCNN4 (0.57) | KCNN4HTR2AHTR2COPRK1KCNH2 | |
| SCHEMBL31437177 | 0.78 | KCNN4 (1.00) | KCNN4HTR2AHTR2COPRK1KCNH2 | |
| SCHEMBL1431670 | 0.78 | KCNN4 (0.56) | KCNN4HTR2AHTR2COPRK1KCNH2 | |
| SCHEMBL31521320 | 0.78 | KCNN4 (0.56) | KCNN4HTR2AHTR2COPRK1KCNH2 | |
| SCHEMBL3669301 | 0.78 | KCNN4 (0.56) | KCNN4HTR2AHTR2COPRK1KCNH2 | |
| SCHEMBL11754835 | 0.77 | KCNN4 (0.55) | KCNN4HTR2AHTR2COPRK1KCNH2 | |
| SCHEMBL10510801 | 0.77 | KCNN4 (0.42) | KCNN4MAPK1MAPTKMT2ACYP3A4 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-100528828-C | Production method of racemiation3-hydroxy-3- (2-phenylethyl) hexanoic acid C1-6 alkyl ester | SUMIKA FINE CHEMICALS CO LTD (JP) | 2009-08-19 | — | — | CN | disclosed |
| CN-1301244-C | Process for producing -3-hydroxy-3- (2-phenylethyl) hexanoic acid and intermediates thereof | SUMITOMO CHEMICAL CO (JP) | 2007-02-21 | — | — | CN | disclosed |
| CN-1617846-A | Process for producing -3-hydroxy-3- (2-phenylethyl) hexanoic acid and intermediates thereof | SUMITOMO CHEMICAL CO (JP) | 2005-05-18 | — | — | CN | disclosed |