Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HCRTR1 | O43613 | 1/20 | 0.41 |
| ▸ | KCNK3 | O14649 | 1/20 | 0.40 |
| ▸ | KCNK9 | Q9NPC2 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 3/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.39 |
| ▸ | TLR2 | O60603 | 1/20 | 0.39 |
| ▸ | ERN1 | O75460 | 1/20 | 0.39 |
| ▸ | TLR1 | Q15399 | 1/20 | 0.39 |
| ▸ | TLR6 | Q9Y2C9 | 1/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.39 |
| ▸ | GLA | P06280 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 2/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | GSK3A | P49840 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | PABPC1 | P11940 | 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 | |
|---|---|---|---|---|
| SCHEMBL8699487 | 0.93 | HCRTR1 (0.46) | HCRTR1ALDH1A1MAPTL3MBTL1NPSR1 | |
| SCHEMBL3128179 | 0.89 | TLR2 (0.46) | SMN1; SMN2ALDH1A1MAPTTLR2ERN1 | |
| SCHEMBL2841391 | 0.83 | ALDH1A1 (0.46) | KCNK3KCNK9SMN1; SMN2ALDH1A1MAPT | |
| SCHEMBL4980596 | 0.81 | HTR1A (0.53) | MAPTL3MBTL1ERN1TDP1 | |
| Acetic Acid SCHEMBL8704644 | 0.80 | CA12 (0.44) | SMN1; SMN2TLR2ERN1TLR1TLR6 | |
| SCHEMBL8701953 | 0.80 | ABCB1 (0.46) | KCNK3KCNK9SMN1; SMN2ALDH1A1MAPT | |
| SCHEMBL22427926 | 0.80 | SMN1; SMN2 (0.45) | KCNK3KCNK9SMN1; SMN2ALDH1A1MAPT | |
| SCHEMBL14135236 | 0.79 | TLR2 (0.41) | SMN1; SMN2ALDH1A1TLR2ERN1TLR1 | |
| SCHEMBL2489060 | 0.79 | HTR1A (0.52) | SMN1; SMN2TDP1 | |
| SCHEMBL8698464 | 0.78 | TRPA1 (0.41) | KCNK3KCNK9SMN1; SMN2ALDH1A1MAPT |
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-1998008837-A1 | PHENYLBUTANOL DERIVATIVES, METHODS FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS THEREOF | FARMACON, INC. (US) | 1998-03-05 | — | — | WO | disclosed |