Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EGFR | P00533 | 4/20 | 0.46 |
| ▸ | ERBB2 | P04626 | 4/20 | 0.46 |
| ▸ | MAPK8 | P45983 | 1/20 | 0.45 |
| ▸ | PARP15 | Q460N3 | 2/20 | 0.43 |
| ▸ | PARP10 | Q53GL7 | 2/20 | 0.43 |
| ▸ | PARP14 | Q460N5 | 1/20 | 0.43 |
| ▸ | PARP1 | P09874 | 1/20 | 0.42 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.42 |
| ▸ | CES1 | P23141 | 1/20 | 0.42 |
| ▸ | MTOR | P42345 | 1/20 | 0.42 |
| ▸ | FFAR1 | O14842 | 2/20 | 0.42 |
| ▸ | FFAR4 | Q5NUL3 | 2/20 | 0.42 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.41 |
| ▸ | IDO1 | P14902 | 1/20 | 0.41 |
| ▸ | AGXT | P21549 | 1/20 | 0.41 |
| ▸ | ESR1 | P03372 | 1/20 | 0.41 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.41 |
| ▸ | PGR | P06401 | 1/20 | 0.41 |
| ▸ | NR3C2 | P08235 | 1/20 | 0.41 |
| ▸ | AR | P10275 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL2578166 | 0.88 | MAPK8 (0.52) | EGFRERBB2MAPK8PARP15PARP10 | |
| Trifluoroacetic Acid SCHEMBL5657379 | 0.83 | CTBP2 (0.50) | PARP1TAAR1CES1IDO1 | |
| Trifluoroacetic Acid SCHEMBL5660867 | 0.83 | SLC1A1 (0.47) | MAPK8PARP10PARP1TAAR1CES1 | |
| Trifluoroacetic Acid SCHEMBL5892868 | 0.81 | CES1 (0.62) | CES1 | |
| Trifluoroacetic Acid SCHEMBL6379095 | 0.81 | HTR3E (0.54) | MAPK8 | |
| Trifluoroacetic Acid SCHEMBL4222769 | 0.81 | CTBP2 (0.51) | MAPK8PARP1TAAR1CES1 | |
| Trifluoroacetic Acid SCHEMBL5659772 | 0.80 | CA2 (0.50) | CES1 | |
| Trifluoroacetic Acid SCHEMBL27484825 | 0.79 | FFAR1 (0.59) | TAAR1FFAR1FFAR4ESR1NR3C1 | |
| Trifluoroacetic Acid SCHEMBL5658158 | 0.78 | CTBP2 (0.55) | MAPK8PARP1TAAR1IDO1AGXT | |
| SCHEMBL4320314 | 0.76 | HCAR2 (0.49) | EGFRERBB2MAPK8PARP15PARP10 |
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 |
|---|---|---|---|---|---|---|---|
| US-7309701-B2 | Pyridazinone derivatives as pharmaceuticals and pharmaceutical compositions containing them | SANOFI-AVENTIS DEUTSCHLAND GMBH (DE) | 2007-12-18 | — | — | US | disclosed |