Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.54 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.54 |
| ▸ | AGTR1 | P30556 | 1/20 | 0.52 |
| ▸ | GLO1 | Q04760 | 1/20 | 0.52 |
| ▸ | PAX8 | Q06710 | 1/20 | 0.52 |
| ▸ | SLC40A1 | Q9NP59 | 1/20 | 0.52 |
| ▸ | GAA | P10253 | 3/20 | 0.50 |
| ▸ | LMNA | P02545 | 2/20 | 0.50 |
| ▸ | MAPT | P10636 | 2/20 | 0.50 |
| ▸ | HTT | P42858 | 2/20 | 0.50 |
| ▸ | RECQL | P46063 | 2/20 | 0.50 |
| ▸ | USP2 | O75604 | 1/20 | 0.50 |
| ▸ | POLB | P06746 | 1/20 | 0.50 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.50 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.50 |
| ▸ | NOD2 | Q9HC29 | 1/20 | 0.50 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.50 |
| ▸ | CA2 | P00918 | 2/20 | 0.49 |
| ▸ | CA9 | Q16790 | 2/20 | 0.49 |
| ▸ | CA12 | O43570 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL28800836 | 0.80 | ALDH1A1 (0.50) | ALDH1A1SMN1; SMN2AGTR1GLO1PAX8 | |
| SCHEMBL2079440 | 0.79 | KEAP1 (0.52) | ALDH1A1GLO1GAAHTTL3MBTL1 | |
| SCHEMBL5014328 | 0.78 | METAP2 (0.50) | ALDH1A1SMN1; SMN2AGTR1GLO1PAX8 | |
| SCHEMBL2067538 | 0.78 | ALDH1A1 (0.68) | ALDH1A1SMN1; SMN2AGTR1GLO1PAX8 | |
| SCHEMBL19921206 | 0.77 | KEAP1 (0.34) | ALDH1A1SMN1; SMN2GLO1GAALMNA | |
| SCHEMBL30102910 | 0.77 | ALDH1A1 (0.74) | ALDH1A1SMN1; SMN2GAALMNAMAPT | |
| SCHEMBL1116405 | 0.77 | ALDH1A1 (0.74) | ALDH1A1SMN1; SMN2GAALMNAMAPT | |
| SCHEMBL11785265 | 0.75 | LMNA (0.77) | ALDH1A1SMN1; SMN2GAALMNAMAPT | |
| SCHEMBL2209258 | 0.73 | FFAR4 (0.51) | ALDH1A1SMN1; SMN2AGTR1GLO1PAX8 | |
| SCHEMBL7589780 | 0.73 | ALDH1A1 (0.69) | ALDH1A1SMN1; SMN2SLC40A1GAAMAPT |
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-2008100618-A2 | CARBON-LINKED TETRAHYDRO-PYRAZOLO-PYRIDINE MODULATORS OF CATHEPSIN S | SUNESIS PHARMACEUTICALS, INC. (US) | 2008-08-21 | — | — | WO | disclosed |