Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2A | P28223 | 3/20 | 0.54 |
| ▸ | SIGMAR1 | Q99720 | 3/20 | 0.54 |
| ▸ | DRD2 | P14416 | 3/20 | 0.54 |
| ▸ | HTR1A | P08908 | 3/20 | 0.54 |
| ▸ | TMEM97 | Q5BJF2 | 2/20 | 0.54 |
| ▸ | DRD3 | P35462 | 2/20 | 0.54 |
| ▸ | HRH1 | P35367 | 1/20 | 0.54 |
| ▸ | SLC6A3 | Q01959 | 3/20 | 0.51 |
| ▸ | DRD1 | P21728 | 1/20 | 0.50 |
| ▸ | DRD5 | P21918 | 1/20 | 0.50 |
| ▸ | HTR7 | P34969 | 1/20 | 0.48 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.48 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.48 |
| ▸ | MEN1 | O00255 | 1/20 | 0.48 |
| ▸ | NPC1 | O15118 | 1/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.48 |
| ▸ | LMNA | P02545 | 1/20 | 0.48 |
| ▸ | TP53 | P04637 | 1/20 | 0.48 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL7408581 | 0.98 | HTR2A (0.52) | HTR2ASIGMAR1DRD2HTR1ATMEM97 | |
| Hydrochloric Acid SCHEMBL7408580 | 0.98 | HTR2A (0.52) | HTR2ASIGMAR1DRD2HTR1ATMEM97 | |
| SCHEMBL10559724 | 0.88 | HTR2A (0.56) | HTR2ASIGMAR1DRD2HTR1ATMEM97 | |
| SCHEMBL10560937 | 0.87 | HTR2A (0.55) | HTR2ASIGMAR1DRD2HTR1ATMEM97 | |
| SCHEMBL10556014 | 0.84 | HTR2A (0.55) | HTR2ASIGMAR1DRD2HTR1ATMEM97 | |
| Oxalic Acid SCHEMBL10461397 | 0.83 | KDM4E (0.58) | HTR2ASIGMAR1DRD2HTR1ATMEM97 | |
| SCHEMBL7410875 | 0.82 | DRD2 (0.50) | HTR2ASIGMAR1DRD2HTR1ATMEM97 | |
| SCHEMBL10560791 | 0.81 | DRD2 (0.57) | HTR2ASIGMAR1DRD2HTR1ATMEM97 | |
| SCHEMBL466855 | 0.81 | HRH3 (0.71) | HTR2ADRD2HTR1ADRD3DRD1 | |
| SCHEMBL10460536 | 0.81 | HTR2A (0.58) | HTR2ASIGMAR1DRD2HTR1ATMEM97 |
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-5198449-A | N-substituted alpha-arylazacycloalkylmethanamines and their use as cardiovascular agents | A. H. ROBINS COMPANY INCORPORATED (US) | 1993-03-30 | — | — | US | disclosed |