Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALOX15 | P16050 | 1/20 | 0.53 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.35 |
| ▸ | MEN1 | O00255 | 2/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.35 |
| ▸ | CHRM5 | P08912 | 2/20 | 0.34 |
| ▸ | CHRM1 | P11229 | 2/20 | 0.34 |
| ▸ | CHRM3 | P20309 | 2/20 | 0.34 |
| ▸ | PGR | P06401 | 1/20 | 0.34 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.34 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.34 |
| ▸ | HTR1A | P08908 | 1/20 | 0.34 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.34 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.34 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.34 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.34 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.34 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | CHRNA10 | Q9GZZ6 | 1/20 | 0.34 |
| ▸ | CHRNA9 | Q9UGM1 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL11442612 | 0.84 | ALOX15 (0.50) | ALOX15ALDH1A1MEN1KMT2ACHRM5 | |
| SCHEMBL7552905 | 0.82 | ALOX15 (0.70) | ALOX15ALDH1A1CHRM5CHRM1CHRM3 | |
| SCHEMBL742283 | 0.78 | — | — | |
| SCHEMBL4153594 | 0.75 | ALDH1A1 (0.52) | ALDH1A1MEN1KMT2ACHRM5CHRM1 | |
| SCHEMBL25341538 | 0.75 | ALOX15 (0.61) | ALOX15ALDH1A1CHRM5CHRM1CHRM3 | |
| SCHEMBL14665241 | 0.75 | ALOX15 (0.61) | ALOX15ALDH1A1CHRM5CHRM1CHRM3 | |
| SCHEMBL7553169 | 0.75 | ALOX15 (0.61) | ALOX15ALDH1A1CHRM5CHRM1CHRM3 | |
| SCHEMBL15542057 | 0.75 | ALOX15 (0.61) | ALOX15ALDH1A1CHRM5CHRM1CHRM3 | |
| SCHEMBL11429849 | 0.73 | ALDH1A1 (0.50) | ALDH1A1MEN1KMT2ACHRM5CHRM1 | |
| SCHEMBL25341103 | 0.73 | ALOX15 (0.59) | ALOX15ALDH1A1CHRM5CHRM1CHRM3 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2009087650-A2 | A NOVEL PROCESS FOR SYNTHESIS OF PREGABALIN FROM SUBSTITUTED CYCLOPROPANE INTERMEDIATE AND A PROCESS FOR ENZYMATIC RESOLUTION OF RACEMIC PREGABALIN | V.B. MEDICARE PVT. LTD. (IN) | 2009-07-16 | — | — | WO | claimed |