Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR4A2 | P43354 | 4/20 | 0.54 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.48 |
| ▸ | CRHR1 | P34998 | 2/20 | 0.42 |
| ▸ | DHODH | Q02127 | 1/20 | 0.41 |
| ▸ | HSD17B2 | P37059 | 4/20 | 0.41 |
| ▸ | HSD17B1 | P14061 | 3/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 2/20 | 0.40 |
| ▸ | GAA | P10253 | 2/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.40 |
| ▸ | PARP1 | P09874 | 1/20 | 0.39 |
| ▸ | PRKAB2 | O43741 | 1/20 | 0.39 |
| ▸ | PRKAG1 | P54619 | 1/20 | 0.39 |
| ▸ | PRKAA2 | P54646 | 1/20 | 0.39 |
| ▸ | PRKAA1 | Q13131 | 1/20 | 0.39 |
| ▸ | PRKAG3 | Q9UGI9 | 1/20 | 0.39 |
| ▸ | PRKAG2 | Q9UGJ0 | 1/20 | 0.39 |
| ▸ | PRKAB1 | Q9Y478 | 1/20 | 0.39 |
| ▸ | MGAM | O43451 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL28046875 | 0.85 | NR4A2 (0.59) | NR4A2CRHR1DHODHMAPTL3MBTL1 | |
| SCHEMBL4017818 | 0.83 | NR4A2 (0.54) | NR4A2CRHR1MAPTGAAL3MBTL1 | |
| SCHEMBL4014169 | 0.81 | PIK3CD (0.46) | PIK3CDHSD17B2HSD17B1CYP3A4MAPT | |
| SCHEMBL4019153 | 0.80 | NR4A2 (0.50) | NR4A2CRHR1CYP3A4MAPTGAA | |
| SCHEMBL1026984 | 0.77 | NR4A2 (0.65) | NR4A2CRHR1DHODHCYP3A4MAPT | |
| SCHEMBL4016535 | 0.77 | PIK3CD (0.61) | NR4A2PIK3CDHSD17B2HSD17B1CYP3A4 | |
| Phenol SCHEMBL28074113 | 0.75 | KDM4E (0.45) | PIK3CDCRHR1HSD17B2HSD17B1CYP2C9 | |
| SCHEMBL3063558 | 0.74 | NR4A2 (0.71) | NR4A2CRHR1DHODHCYP3A4MAPT | |
| SCHEMBL28176160 | 0.74 | HSD17B1 (0.47) | CRHR1DHODHHSD17B2HSD17B1CYP2C9 | |
| SCHEMBL4018305 | 0.73 | NR1H2 (0.45) | NR4A2CRHR1DHODHPARP1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2074098-A2 | QUINOLINE COMPOUNDS | Wyeth (US) | 2009-07-01 | — | — | EP | disclosed |
| WO-2008049047-A2 | QUINOLINE COMPOUNDS | WYETH (US) | 2008-04-24 | — | — | WO | disclosed |