Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HPGD | P15428 | 3/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.31 |
| ▸ | NAAA | Q02083 | 1/20 | 0.31 |
| ▸ | GFER | P55789 | 1/20 | 0.30 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.30 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.30 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.30 |
| ▸ | HIF1A | Q16665 | 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 | |
|---|---|---|---|---|
| SCHEMBL15054446 | 0.99 | HPGD (0.33) | HPGDSMN1; SMN2TRPV1KMT2AALDH1A1 | |
| SCHEMBL15054697 | 0.74 | HPGD (0.34) | HPGDSMN1; SMN2TRPV1KMT2AALDH1A1 | |
| SCHEMBL9577327 | 0.72 | HDAC3 (0.39) | — | |
| SCHEMBL15054489 | 0.69 | HPGD (0.34) | HPGDSMN1; SMN2TRPV1KMT2AALDH1A1 | |
| SCHEMBL15054116 | 0.68 | POLB (0.36) | HPGDSMN1; SMN2KMT2AALDH1A1L3MBTL1 | |
| SCHEMBL5569558 | 0.65 | KDM4E (0.55) | SMN1; SMN2KMT2AALDH1A1KDM4EMAPK1 | |
| SCHEMBL15871737 | 0.65 | KDM4E (0.55) | SMN1; SMN2KMT2AALDH1A1KDM4EMAPK1 | |
| SCHEMBL20836564 | 0.65 | KDM4E (0.55) | SMN1; SMN2KMT2AALDH1A1KDM4EMAPK1 | |
| SCHEMBL2029681 | 0.65 | KDM4E (0.55) | SMN1; SMN2KMT2AALDH1A1KDM4EMAPK1 | |
| SCHEMBL30541972 | 0.65 | KDM4E (0.55) | SMN1; SMN2KMT2AALDH1A1KDM4EMAPK1 |
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-2013095301-A1 | METHOD OF PREPARING CHIRAL KETONES FROM ALDEHYDES | NANYANG TECHNOLOGICAL UNIVERSITY (SG) | 2013-06-27 | — | — | WO | disclosed |