Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTT | P42858 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | HMGCR | P04035 | 1/20 | 0.31 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.31 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.31 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 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 | |
|---|---|---|---|---|
| SCHEMBL13852330 | 1.00 | HTT (0.34) | HTTSMN1; SMN2HMGCRCHRM1TBXA2R | |
| SCHEMBL291545 | 0.82 | KDM4E (0.45) | HTTSMN1; SMN2HMGCRCHRM1TBXA2R | |
| SCHEMBL9352777 | 0.82 | PIK3CD (0.39) | HMGCRCHRM1TBXA2RADRA1AALDH1A1 | |
| SCHEMBL291544 | 0.82 | KDM4E (0.45) | HTTSMN1; SMN2HMGCRCHRM1TBXA2R | |
| SCHEMBL9352772 | 0.82 | PIK3CD (0.39) | HMGCRCHRM1TBXA2RADRA1AALDH1A1 | |
| SCHEMBL11921840 | 0.82 | HTT (0.33) | HTTSMN1; SMN2 | |
| SCHEMBL11214676 | 0.80 | POLB (0.47) | HTTSMN1; SMN2 | |
| SCHEMBL5935822 | 0.78 | HTT (0.32) | HTTSMN1; SMN2 | |
| SCHEMBL5935821 | 0.78 | HTT (0.32) | HTTSMN1; SMN2 | |
| SCHEMBL3631792 | 0.72 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-2543437-A2 | HOMOGENEOUS ASYMMETRIC HYDROGENATION CATALYST | Takasago International Corporation (JP) | 2013-01-09 | — | — | EP | disclosed |
| WO-2011108672-A2 | HOMOGENEOUS ASYMMETRIC HYDROGENATION CATALYST | 高砂香料工業株式会社 (JP) | 2011-09-09 | — | — | WO | disclosed |