Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C9 | P11712 | 2/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | PDPK1 | O15530 | 1/20 | 0.41 |
| ▸ | HDAC8 | Q9BY41 | 8/20 | 0.39 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.39 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.39 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.39 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.39 |
| ▸ | NR4A1 | P22736 | 1/20 | 0.39 |
| ▸ | NR4A2 | P43354 | 1/20 | 0.39 |
| ▸ | NR4A3 | Q92570 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | EPHX1 | P07099 | 2/20 | 0.38 |
| ▸ | MRGPRX4 | Q96LA9 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.38 |
| ▸ | ATM | Q13315 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 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 | |
|---|---|---|---|---|
| SCHEMBL6204074 | 0.83 | MDM2 (0.41) | TSHR | |
| SCHEMBL6400617 | 0.75 | NPC1 (0.44) | MAPTL3MBTL1CYP1A2 | |
| SCHEMBL29926553 | 0.74 | PDPK1 (0.53) | PDPK1HDAC8HDAC3HDAC1HDAC2 | |
| SCHEMBL10829635 | 0.74 | PDPK1 (0.53) | PDPK1HDAC8HDAC3HDAC1HDAC2 | |
| SCHEMBL6005346 | 0.70 | HDAC8 (0.54) | CYP2C9CYP3A4PDPK1HDAC8HDAC3 | |
| SCHEMBL6202771 | 0.67 | KMT2A (0.54) | PDPK1HDAC8HDAC3HDAC1HDAC2 | |
| SCHEMBL11851540 | 0.66 | HDAC8 (0.44) | CYP2C9CYP3A4PDPK1HDAC8HDAC3 | |
| SCHEMBL3371893 | 0.66 | FFAR2 (0.42) | TSHRL3MBTL1MEN1CYP1A2KMT2A | |
| SCHEMBL11458388 | 0.66 | IDO1 (0.49) | CYP2C9CYP3A4HDAC8HDAC3HDAC1 | |
| SCHEMBL11857052 | 0.65 | HDAC8 (0.55) | CYP2C9CYP3A4HDAC8HDAC3HDAC1 |
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 |