Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD2 | P14416 | 2/20 | 0.51 |
| ▸ | RAB9A | P51151 | 2/20 | 0.48 |
| ▸ | NPC1 | O15118 | 1/20 | 0.48 |
| ▸ | CES2 | O00748 | 1/20 | 0.47 |
| ▸ | CES1 | P23141 | 1/20 | 0.47 |
| ▸ | SLC5A1 | P13866 | 1/20 | 0.47 |
| ▸ | SLC5A2 | P31639 | 1/20 | 0.47 |
| ▸ | MDM2 | Q00987 | 2/20 | 0.46 |
| ▸ | ACKR3 | P25106 | 2/20 | 0.45 |
| ▸ | MAOA | P21397 | 1/20 | 0.44 |
| ▸ | MAOB | P27338 | 1/20 | 0.44 |
| ▸ | PLAAT3 | P53816 | 1/20 | 0.43 |
| ▸ | PLAAT5 | Q96KN8 | 1/20 | 0.43 |
| ▸ | PLAAT2 | Q9NWW9 | 1/20 | 0.43 |
| ▸ | PLAAT4 | Q9UL19 | 1/20 | 0.43 |
| ▸ | CNR1 | P21554 | 1/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.42 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.42 |
| ▸ | GPR84 | Q9NQS5 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL6203033 | 0.91 | SLC5A1 (0.55) | RAB9ANPC1CES2CES1SLC5A1 | |
| SCHEMBL6161424 | 0.85 | CES2 (0.47) | RAB9ACES2CES1SLC5A1SLC5A2 | |
| SCHEMBL13988809 | 0.82 | MEN1 (0.48) | RAB9ANPC1SLC5A1SLC5A2PLAAT3 | |
| SCHEMBL656917 | 0.81 | CYP19A1 (0.51) | DRD2RAB9ANPC1CES2CES1 | |
| SCHEMBL24511805 | 0.80 | MCHR1 (0.47) | CYP11B1CYP11B2 | |
| SCHEMBL657632 | 0.78 | TP53 (0.59) | DRD2RAB9ANPC1SLC5A1SLC5A2 | |
| SCHEMBL6202254 | 0.78 | TP53 (0.59) | DRD2RAB9ANPC1SLC5A1SLC5A2 | |
| SCHEMBL3739418 | 0.78 | ALDH1A1 (0.61) | RAB9APLAAT3PLAAT5PLAAT2PLAAT4 | |
| SCHEMBL959448 | 0.77 | CES2 (0.57) | DRD2RAB9ANPC1CES2CES1 | |
| SCHEMBL656153 | 0.76 | GPR84 (0.55) | DRD2RAB9ANPC1CES2CES1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20050272036-A1 | Ketones | ASTRAZENECA AB (SE) | 2005-12-08 | — | — | US | disclosed |
| EP-1549600-A1 | KETONES | AstraZeneca AB (SE) | 2005-07-06 | — | — | EP | disclosed |
| WO-2004011410-A1 | CHEMICAL COMPOUNDS | ASTRAZENECA AB (SE) | 2004-02-05 | — | — | WO | disclosed |