Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 3/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.38 |
| ▸ | LMNA | P02545 | 2/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | HDAC3 | O15379 | 5/20 | 0.37 |
| ▸ | HDAC4 | P56524 | 5/20 | 0.37 |
| ▸ | HDAC1 | Q13547 | 5/20 | 0.37 |
| ▸ | HDAC7 | Q8WUI4 | 5/20 | 0.37 |
| ▸ | HDAC2 | Q92769 | 5/20 | 0.37 |
| ▸ | HDAC10 | Q969S8 | 5/20 | 0.37 |
| ▸ | HDAC11 | Q96DB2 | 5/20 | 0.37 |
| ▸ | HDAC8 | Q9BY41 | 5/20 | 0.37 |
| ▸ | HDAC6 | Q9UBN7 | 5/20 | 0.37 |
| ▸ | HDAC9 | Q9UKV0 | 5/20 | 0.37 |
| ▸ | HDAC5 | Q9UQL6 | 5/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.36 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.36 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL8166179 | 0.86 | CYP1A2 (0.48) | CYP1A2MAPTLMNATSHRHDAC3 | |
| SCHEMBL27621428 | 0.79 | CYP1A2 (0.48) | CYP1A2MAPTTSHRHDAC3HDAC4 | |
| SCHEMBL28021844 | 0.77 | CYP1A2 (0.47) | CYP1A2MAPTTSHRHDAC3HDAC4 | |
| SCHEMBL8376477 | 0.76 | TSHR (0.42) | CYP1A2TDP1TSHRCYP2C19KIF11 | |
| SCHEMBL3279812 | 0.75 | CYP2C19 (0.42) | CYP1A2MAPTL3MBTL1LMNATDP1 | |
| SCHEMBL6682657 | 0.75 | TSHR (0.41) | TSHRGAAKIF11MEN1KMT2A | |
| SCHEMBL8166172 | 0.74 | TSHR (0.37) | CYP1A2TSHRHIF1AALDH1A1KIF11 | |
| SCHEMBL8161300 | 0.74 | CYP1A2 (0.52) | CYP1A2MAPTLMNATSHRHDAC3 | |
| SCHEMBL3280032 | 0.74 | CYP2C19 (0.49) | CYP1A2MAPTL3MBTL1LMNATDP1 | |
| SCHEMBL3279710 | 0.74 | CYP2C19 (0.41) | CYP1A2MAPTL3MBTL1LMNATDP1 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2000075094-A2 | METHOD FOR PRODUCING A HALOGENATED ACETOPHENONE | ISHIHARA SANGYO KAISHA, LTD. (JP) | 2000-12-14 | — | — | WO | disclosed |