Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACP3 | P15309 | 1/20 | 0.54 |
| ▸ | PBRM1 | Q86U86 | 1/20 | 0.49 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.49 |
| ▸ | NPC1 | O15118 | 2/20 | 0.48 |
| ▸ | MAPT | P10636 | 2/20 | 0.48 |
| ▸ | RAB9A | P51151 | 2/20 | 0.48 |
| ▸ | PAX8 | Q06710 | 1/20 | 0.48 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.48 |
| ▸ | CES2 | O00748 | 1/20 | 0.47 |
| ▸ | CES1 | P23141 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.47 |
| ▸ | CNR2 | P34972 | 2/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.47 |
| ▸ | CNR1 | P21554 | 1/20 | 0.47 |
| ▸ | TP53 | P04637 | 1/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.47 |
| ▸ | GAA | P10253 | 3/20 | 0.46 |
| ▸ | LMNA | P02545 | 1/20 | 0.46 |
| ▸ | GPR88 | Q9GZN0 | 1/20 | 0.46 |
| ▸ | POLB | P06746 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL107151 | 0.86 | HPGD (0.48) | MAPTCES2CES1ALDH1A1KMT2A | |
| SCHEMBL3698934 | 0.85 | GAA (0.49) | NPSR1ALDH1A1CNR2KMT2ACNR1 | |
| SCHEMBL3693512 | 0.85 | BRD4 (0.54) | L3MBTL1NPC1RAB9AALDH1A1CNR2 | |
| SCHEMBL3691939 | 0.84 | HPGD (0.43) | ACP3L3MBTL1NPC1MAPTRAB9A | |
| SCHEMBL3698284 | 0.81 | ALDH1A1 (0.49) | L3MBTL1NPC1MAPTRAB9ANPSR1 | |
| Acetic Acid SCHEMBL28833358 | 0.81 | ACP3 (0.59) | ACP3L3MBTL1NPC1MAPTRAB9A | |
| SCHEMBL6755554 | 0.81 | ACP3 (0.59) | ACP3L3MBTL1NPC1MAPTRAB9A | |
| SCHEMBL176065 | 0.81 | LMNA (0.44) | NPSR1CES2ALDH1A1CNR2KMT2A | |
| SCHEMBL3685881 | 0.80 | NPC1 (0.44) | ACP3L3MBTL1NPC1MAPTRAB9A | |
| SCHEMBL5941221 | 0.80 | PBRM1 (0.62) | ACP3PBRM1L3MBTL1NPC1MAPT |
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 |