Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | THRB | P10828 | 1/20 | 0.53 |
| ▸ | DPP4 | P27487 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | CYP8B1 | Q9UNU6 | 3/20 | 0.40 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.40 |
| ▸ | NCF1 | P14598 | 1/20 | 0.40 |
| ▸ | LIPG | Q9Y5X9 | 1/20 | 0.39 |
| ▸ | CSF1R | P07333 | 1/20 | 0.38 |
| ▸ | SCN10A | Q9Y5Y9 | 1/20 | 0.38 |
| ▸ | PLK4 | O00444 | 1/20 | 0.38 |
| ▸ | DYRK3 | O43781 | 1/20 | 0.38 |
| ▸ | PRKD3 | O94806 | 1/20 | 0.38 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.38 |
| ▸ | CHEK2 | O96017 | 1/20 | 0.38 |
| ▸ | FGFR1 | P11362 | 1/20 | 0.38 |
| ▸ | CDK2 | P24941 | 1/20 | 0.38 |
| ▸ | FLT4 | P35916 | 1/20 | 0.38 |
| ▸ | KDR | P35968 | 1/20 | 0.38 |
| ▸ | CLK2 | P49760 | 1/20 | 0.38 |
| ▸ | GSK3A | P49840 | 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 | |
|---|---|---|---|---|
| SCHEMBL4743041 | 0.88 | THRB (0.55) | THRBCYP8B1ADRB2NCF1LIPG | |
| SCHEMBL4743063 | 0.86 | THRB (0.56) | THRBALDH1A1SMN1; SMN2HSD17B10 | |
| SCHEMBL4742585 | 0.84 | THRB (0.75) | THRBALDH1A1HSD17B10 | |
| SCHEMBL4739993 | 0.80 | THRB (0.54) | THRBCYP8B1SMN1; SMN2HPGD | |
| Trifluoroacetic Acid SCHEMBL4742140 | 0.79 | THRB (0.43) | THRBDPP4CYP8B1SCN10AALDH1A1 | |
| SCHEMBL4785514 | 0.75 | THRB (0.46) | THRBDPP4CYP8B1ADRB2NCF1 | |
| SCHEMBL3887756 | 0.75 | ALDH1A1 (0.46) | THRBCSF1RPLK4DYRK3PRKD3 | |
| SCHEMBL30592902 | 0.75 | ALDH1A1 (0.46) | THRBCSF1RPLK4DYRK3PRKD3 | |
| SCHEMBL4785468 | 0.75 | THRB (0.45) | THRBDPP4CYP8B1SCN10A | |
| Hydrochloric Acid SCHEMBL11870232 | 0.74 | ALDH1A1 (0.45) | THRBCSF1RPLK4DYRK3PRKD3 |
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-2008093940-A1 | QUINOLINE DERIVATIVES AS CASPASE-3 INHIBITOR, PREPARATION PROCESS FOR THE SAME AND PHARMACEUTICAL COMPOSITION COMPRISING THE SAME | YUNGJIN PHARMACEUTICAL CO., LTD. (KR) | 2008-08-07 | — | — | WO | disclosed |