Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IAPP | P10997 | 5/20 | 0.57 |
| ▸ | SOX18 | P35713 | 1/20 | 0.41 |
| ▸ | CCNC | P24863 | 3/20 | 0.39 |
| ▸ | CDK8 | P49336 | 3/20 | 0.39 |
| ▸ | ACMSD | Q8TDX5 | 1/20 | 0.39 |
| ▸ | MTNR1A | P48039 | 3/20 | 0.38 |
| ▸ | GSK3A | P49840 | 1/20 | 0.38 |
| ▸ | GSK3B | P49841 | 1/20 | 0.38 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.38 |
| ▸ | CNR2 | P34972 | 1/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | RAB9A | P51151 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | MTNR1B | P49286 | 1/20 | 0.37 |
| ▸ | HSD17B1 | P14061 | 1/20 | 0.37 |
| ▸ | HSD17B2 | P37059 | 1/20 | 0.37 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.37 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.37 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL3692509 | 0.84 | ALOX5 (0.44) | IAPPCCNCCDK8MTNR1AALOX5 | |
| SCHEMBL3694985 | 0.83 | IAPP (0.64) | IAPP | |
| SCHEMBL3691581 | 0.81 | IAPP (0.58) | IAPPMTNR1ANPC1ALDH1A1RAB9A | |
| SCHEMBL3698568 | 0.81 | IAPP (0.61) | IAPP | |
| SCHEMBL8005173 | 0.76 | IAPP (0.75) | IAPPNPC1RAB9A | |
| SCHEMBL8101979 | 0.74 | HTR2A (0.47) | SOX18ALOX5HSD17B1HSD17B2 | |
| SCHEMBL297384 | 0.72 | ALOX5 (0.61) | ACMSDALOX5HSD17B1HSD17B2HDAC4 | |
| SCHEMBL3358215 | 0.69 | ALOX5 (0.52) | ACMSDALOX5NPC1RAB9AHSD17B1 | |
| SCHEMBL3699529 | 0.68 | IAPP (0.48) | IAPPMTNR1ANPC1ALDH1A1RAB9A | |
| SCHEMBL11751573 | 0.67 | IAPP (0.59) | IAPPNPC1RAB9A |
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-2227449-A1 | NOVEL BETA-HYDROXYKETONES AND BETA-ALKOXYKETONES WITH ESTROGENIC ACTIVITY | Pulkkinen, Juha (FI) | 2010-09-15 | — | — | EP | disclosed |
| WO-2009066008-A1 | NOVEL BETA-HYDROXYKETONES AND BETA-ALKOXYKETONES WITH ESTROGENIC ACTIVITY | PULKKINEN JUHA (FI) | 2009-05-28 | — | — | WO | disclosed |