Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2C | P28335 | 1/20 | 0.56 |
| ▸ | HTR2B | P41595 | 1/20 | 0.56 |
| ▸ | SLC6A2 | P23975 | 5/20 | 0.53 |
| ▸ | HTR1A | P08908 | 3/20 | 0.53 |
| ▸ | ROCK1 | Q13464 | 2/20 | 0.51 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.49 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.49 |
| ▸ | IKBKB | O14920 | 1/20 | 0.46 |
| ▸ | CHUK | O15111 | 1/20 | 0.46 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.46 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.46 |
| ▸ | ALOX5AP | P20292 | 3/20 | 0.46 |
| ▸ | FEN1 | P39748 | 3/20 | 0.46 |
| ▸ | CD274 | Q9NZQ7 | 1/20 | 0.43 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL3330561 | 0.90 | HTR2C (0.67) | HTR2CHTR2BSLC6A2HTR1ACHRNB2 | |
| SCHEMBL3168067 | 0.90 | HTR2C (0.67) | HTR2CHTR2BSLC6A2HTR1ACHRNB2 | |
| SCHEMBL3175157 | 0.90 | HTR2C (0.67) | HTR2CHTR2BSLC6A2HTR1ACHRNB2 | |
| Hydrochloric Acid SCHEMBL4112913 | 0.89 | HTR2C (0.65) | HTR2CHTR2BSLC6A2HTR1ACHRNB2 | |
| Hydrochloric Acid SCHEMBL4124903 | 0.89 | HTR2C (0.65) | HTR2CHTR2BSLC6A2HTR1ACHRNB2 | |
| Tert-Butyl Formate SCHEMBL28277465 | 0.87 | HTR2C (0.46) | HTR2CHTR2BSLC6A2HTR1AROCK1 | |
| SCHEMBL26712584 | 0.83 | SLC6A2 (0.58) | HTR2CHTR2BSLC6A2HTR1ASLC6A4 | |
| SCHEMBL15318611 | 0.82 | ROCK1 (0.53) | HTR2CHTR2BSLC6A2HTR1AROCK1 | |
| SCHEMBL13696497 | 0.81 | SLC6A2 (0.49) | HTR2CHTR2BSLC6A2SLC6A4SLC6A3 | |
| SCHEMBL7701922 | 0.81 | SLC6A2 (0.49) | SLC6A2SLC6A4SLC6A3 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2607364-A1 | Tetraaza-cyclopenta[a]indenyl and their use as positive allosteric modulators | Ares Trading S.A. (CH) | 2013-06-26 | — | — | EP | disclosed |