Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | POLB | P06746 | 1/20 | 0.50 |
| ▸ | NPC1 | O15118 | 1/20 | 0.46 |
| ▸ | RAB9A | P51151 | 1/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.46 |
| ▸ | HPGD | P15428 | 1/20 | 0.44 |
| ▸ | MEN1 | O00255 | 4/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.43 |
| ▸ | GRIN2D | O15399 | 1/20 | 0.43 |
| ▸ | GRIN3B | O60391 | 1/20 | 0.43 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.43 |
| ▸ | GRIN2A | Q12879 | 1/20 | 0.43 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.43 |
| ▸ | GRIN2C | Q14957 | 1/20 | 0.43 |
| ▸ | GRIN3A | Q8TCU5 | 1/20 | 0.43 |
| ▸ | ELANE | P08246 | 1/20 | 0.42 |
| ▸ | CES1 | P23141 | 3/20 | 0.42 |
| ▸ | CES2 | O00748 | 2/20 | 0.42 |
| ▸ | PPARA | Q07869 | 2/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL11525745 | 0.84 | SRD5A2 (0.52) | SMN1; SMN2HPGDMEN1KMT2ACYP1A2 | |
| SCHEMBL10816935 | 0.80 | CES1 (0.62) | POLBNPC1RAB9ASMN1; SMN2HPGD | |
| SCHEMBL6676984 | 0.79 | PPARA (0.49) | POLBNPC1RAB9ASMN1; SMN2HPGD | |
| SCHEMBL1487886 | 0.78 | CES1 (0.65) | KMT2ACYP2C19ELANECES1CES2 | |
| Water SCHEMBL8542684 | 0.76 | CES1 (0.62) | KMT2ACYP2C19ELANECES1CES2 | |
| SCHEMBL6202666 | 0.76 | CES1 (0.53) | POLBNPC1RAB9ASMN1; SMN2MEN1 | |
| SCHEMBL10812552 | 0.76 | HPGD (0.48) | POLBHPGDELANECES1CES2 | |
| SCHEMBL6203218 | 0.76 | POLB (0.55) | POLBNPC1RAB9ASMN1; SMN2MEN1 | |
| SCHEMBL14430932 | 0.75 | GRIN2D (0.43) | POLBNPC1RAB9ASMN1; SMN2HPGD | |
| SCHEMBL17187854 | 0.74 | CES2 (0.54) | POLBNPC1RAB9ASMN1; SMN2HPGD |
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 |