Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2D6 | P10635 | 2/20 | 0.41 |
| ▸ | SRC | P12931 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.41 |
| ▸ | TSHR | P16473 | 2/20 | 0.41 |
| ▸ | LMNA | P02545 | 3/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.39 |
| ▸ | MTNR1B | P49286 | 1/20 | 0.39 |
| ▸ | CES2 | O00748 | 1/20 | 0.39 |
| ▸ | CES1 | P23141 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | CNR1 | P21554 | 1/20 | 0.38 |
| ▸ | CNR2 | P34972 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL6404252 | 0.88 | CYP2D6 (0.46) | CYP2D6SRCCYP2C19LMNAMAPK1 | |
| SCHEMBL7910713 | 0.88 | CYP2D6 (0.48) | CYP2D6SRCCYP2C19TSHRLMNA | |
| SCHEMBL1132531 | 0.88 | CYP2D6 (0.48) | CYP2D6SRCCYP2C19TSHRLMNA | |
| SCHEMBL8161664 | 0.86 | TBXAS1 (0.42) | CYP2D6SRCCYP2C19TSHRLMNA | |
| SCHEMBL7407170 | 0.84 | ALDH1A1 (0.47) | CYP2D6SRCCYP2C19TSHRLMNA | |
| SCHEMBL27913389 | 0.82 | L3MBTL1 (0.52) | CYP2C19TSHRLMNAMAPK1ALDH1A1 | |
| SCHEMBL28304435 | 0.82 | HDAC3 (0.46) | CYP2D6SRCCYP2C19TSHRLMNA | |
| SCHEMBL27308604 | 0.82 | CES2 (0.41) | CYP2D6CYP2C19TSHRLMNAMAPK1 | |
| SCHEMBL11273044 | 0.81 | HPGD (0.41) | CYP2D6SRCCYP2C19TSHRLMNA | |
| SCHEMBL8494351 | 0.80 | MTNR1A (0.52) | CYP2D6SRCLMNAMAPK1MTNR1A |
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 |