Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.50 |
| ▸ | HTR1A | P08908 | 3/20 | 0.42 |
| ▸ | ADRA1D | P25100 | 3/20 | 0.42 |
| ▸ | ADRA1A | P35348 | 3/20 | 0.42 |
| ▸ | ADRA1B | P35368 | 3/20 | 0.42 |
| ▸ | CRHR1 | P34998 | 7/20 | 0.41 |
| ▸ | GAA | P10253 | 2/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | LIMK1 | P53667 | 1/20 | 0.39 |
| ▸ | LIMK2 | P53671 | 1/20 | 0.39 |
| ▸ | HTR2A | P28223 | 2/20 | 0.39 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.39 |
| ▸ | KCNH2 | Q12809 | 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 | |
|---|---|---|---|---|
| SCHEMBL7529401 | 0.86 | TDP1 (0.66) | TDP1HTR1AADRA1DADRA1AADRA1B | |
| SCHEMBL13798597 | 0.86 | TDP1 (0.45) | TDP1CRHR1GAAMAPTHTR2A | |
| SCHEMBL11232288 | 0.85 | TDP1 (0.49) | TDP1HTR1AADRA1DADRA1AADRA1B | |
| Hydrochloric Acid SCHEMBL27802033 | 0.84 | TDP1 (0.44) | TDP1CRHR1GAAMAPTHTR2A | |
| SCHEMBL12963726 | 0.81 | GAA (0.51) | TDP1HTR1AADRA1DADRA1AADRA1B | |
| SCHEMBL23121234 | 0.80 | TDP1 (0.79) | TDP1MAPT | |
| SCHEMBL29606425 | 0.80 | TDP1 (0.79) | TDP1MAPT | |
| SCHEMBL10855864 | 0.79 | IDO1 (0.47) | TDP1HTR1AADRA1DADRA1AADRA1B | |
| SCHEMBL18893410 | 0.79 | GAA (0.44) | TDP1HTR1AADRA1DADRA1AADRA1B | |
| SCHEMBL19848147 | 0.79 | TDP1 (0.43) | TDP1HTR1AADRA1DADRA1AADRA1B |
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-9656956-B2 | Benzene, pyridine, and pyridazine derivatives | ESANEX, INC. (US) | 2017-05-23 | — | — | US | disclosed |