Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR1D | P28221 | 1/20 | 0.35 |
| ▸ | HTR1B | P28222 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | PKM | P14618 | 1/20 | 0.31 |
| ▸ | ESR1 | P03372 | 2/20 | 0.30 |
| ▸ | ESR2 | Q92731 | 2/20 | 0.30 |
| ▸ | AR | P10275 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL2102413 | 0.78 | — | — | |
| SCHEMBL8827947 | 0.75 | ESR1 (0.43) | HTR1DHTR1BESR1ESR2AR | |
| SCHEMBL11050063 | 0.75 | NOS2 (0.34) | HTR1DHTR1B | |
| SCHEMBL2103783 | 0.75 | TAAR1 (0.46) | HTR1DALDH1A1AR | |
| SCHEMBL9648247 | 0.73 | ALDH1A1 (0.37) | ALDH1A1 | |
| SCHEMBL10405991 | 0.72 | — | — | |
| SCHEMBL4628344 | 0.72 | GABRA1 (0.35) | ALDH1A1 | |
| SCHEMBL9645373 | 0.72 | NNMT (0.32) | — | |
| SCHEMBL10406697 | 0.71 | HTR1D (0.41) | HTR1DHTR1B | |
| Detomidine SCHEMBL7087060 | 0.71 | ALDH1A1 (0.35) | HTR1BALDH1A1ESR1ESR2 |
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-2018087160-A1 | SUBSTITUTED HETEROCYCLIC COMPOUNDS FOR USE IN CONTROLLING PARASITIC CRUSTACEANS ON FISH | I-TECH AB (SE) | 2018-05-17 | — | — | WO | disclosed |