Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GFER | P55789 | 1/20 | 0.54 |
| ▸ | CA2 | P00918 | 3/20 | 0.48 |
| ▸ | LPL | P06858 | 1/20 | 0.47 |
| ▸ | LIPG | Q9Y5X9 | 1/20 | 0.47 |
| ▸ | MAOB | P27338 | 4/20 | 0.46 |
| ▸ | MAOA | P21397 | 2/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.44 |
| ▸ | CA12 | O43570 | 1/20 | 0.44 |
| ▸ | CA1 | P00915 | 1/20 | 0.44 |
| ▸ | CA4 | P22748 | 1/20 | 0.44 |
| ▸ | CA6 | P23280 | 1/20 | 0.44 |
| ▸ | CA5A | P35218 | 1/20 | 0.44 |
| ▸ | CA7 | P43166 | 1/20 | 0.44 |
| ▸ | CA9 | Q16790 | 1/20 | 0.44 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.44 |
| ▸ | CA5B | Q9Y2D0 | 1/20 | 0.44 |
| ▸ | CYP4F2 | P78329 | 2/20 | 0.43 |
| ▸ | CYP4A11 | Q02928 | 2/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL6051 | 0.89 | GFER (0.68) | GFERCA2MAOBMAOATDP1 | |
| SCHEMBL5962 | 0.89 | GFER (0.68) | GFERCA2LPLLIPGMAOB | |
| SCHEMBL7643947 | 0.89 | CA2 (0.59) | CA2LPLLIPGTDP1CA12 | |
| Ammonia Solution, Strong SCHEMBL9651935 | 0.86 | CA2 (0.56) | CA2LPLLIPGTDP1CA12 | |
| SCHEMBL29155827 | 0.86 | GFER (0.65) | GFERCA2LPLLIPGMAOB | |
| Nitrogen SCHEMBL28535878 | 0.84 | GFER (0.62) | GFERCA2MAOBMAOATDP1 | |
| Ethylamine SCHEMBL27859952 | 0.84 | GFER (0.62) | GFERCA2LPLLIPGMAOB | |
| SCHEMBL7143471 | 0.82 | GFER (0.59) | GFERCA2MAOBMAOATDP1 | |
| SCHEMBL1696232 | 0.82 | GFER (0.59) | GFERCA2LPLLIPGMAOB | |
| 4,4'-Methylenedianiline SCHEMBL11590275 | 0.82 | CYP3A4 (0.67) | GFERCA2LPLLIPGMAOB |
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-1019720-A1 | COMBINATORIAL PROCESS FOR PREPARING TETRAHYDROQUINOLINE LIBRARIES | ELI LILLY AND COMPANY (US) | 2000-07-19 | — | — | EP | disclosed |
| WO-1998027427-A1 | COMBINATORIAL PROCESS FOR PREPARING TETRAHYDROQUINOLINE LIBRARIES | ELI LILLY AND COMPANY (US) | 1998-06-25 | — | — | WO | disclosed |