Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR6 | P50406 | 6/20 | 0.72 |
| ▸ | HTR1D | P28221 | 5/20 | 0.72 |
| ▸ | TSHR | P16473 | 3/20 | 0.63 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.63 |
| ▸ | MTNR1A | P48039 | 2/20 | 0.63 |
| ▸ | MTNR1B | P49286 | 2/20 | 0.63 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.63 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.63 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.63 |
| ▸ | NQO2 | P16083 | 1/20 | 0.63 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.63 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.59 |
| ▸ | HTR1A | P08908 | 4/20 | 0.54 |
| ▸ | HTR7 | P34969 | 4/20 | 0.54 |
| ▸ | MAPT | P10636 | 4/20 | 0.54 |
| ▸ | HTR2A | P28223 | 3/20 | 0.54 |
| ▸ | TRPM8 | Q7Z2W7 | 2/20 | 0.54 |
| ▸ | HTR2C | P28335 | 2/20 | 0.54 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.54 |
| ▸ | HTR1B | P28222 | 1/20 | 0.54 |
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 | |
|---|---|---|---|---|
| SCHEMBL25969437 | 0.87 | MTNR1A (0.64) | HTR6HTR1DTSHRCYP1A2MTNR1A | |
| SCHEMBL4244966 | 0.84 | HTR1D (1.00) | HTR6HTR1DTSHRCYP1A2MTNR1A | |
| SCHEMBL8229569 | 0.82 | HTR6 (0.72) | HTR6HTR1DTSHRCYP1A2MTNR1A | |
| Hydrochloric Acid SCHEMBL7433474 | 0.82 | HTR1D (0.97) | HTR6HTR1DTSHRCYP1A2MTNR1A | |
| SCHEMBL8691195 | 0.81 | HTR6 (0.71) | HTR6HTR1DTSHRCYP1A2MTNR1A | |
| SCHEMBL8947088 | 0.81 | HTR6 (0.73) | HTR6HTR1DCYP1A2MTNR1AMTNR1B | |
| SCHEMBL8947058 | 0.80 | HTR6 (0.68) | HTR6HTR1DTSHRCYP1A2MTNR1A | |
| Cyanide SCHEMBL28561862 | 0.80 | HTR1D (0.92) | HTR6HTR1DTSHRCYP1A2MTNR1A | |
| SCHEMBL25969475 | 0.79 | TSHR (0.56) | HTR6HTR1DTSHRCYP1A2MTNR1A | |
| SCHEMBL2403262 | 0.78 | HTR1D (0.65) | HTR6HTR1DTSHRCYP1A2MTNR1A |
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-5552428-A | ANTIARRHYTHMIA AGENTS FOR CARDIOVASCULAR DISORDERS USING MELATONIN DERIVATIVES | INSTITUTO FARMACOLOGICO LOMBARDO-IFLO, S.A.S. (IT) | 1996-09-03 | — | — | US | disclosed |