Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MLNR | O43193 | 1/20 | 0.72 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.72 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.72 |
| ▸ | DRD2 | P14416 | 1/20 | 0.72 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.72 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.72 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.72 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.72 |
| ▸ | HTR2A | P28223 | 1/20 | 0.72 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.72 |
| ▸ | HRH1 | P35367 | 1/20 | 0.72 |
| ▸ | DRD3 | P35462 | 1/20 | 0.72 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.72 |
| ▸ | HTR2B | P41595 | 1/20 | 0.72 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.72 |
| ▸ | HTR3A | P46098 | 1/20 | 0.72 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.72 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.72 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.72 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL6903359 | 1.00 | MLNR (0.72) | MLNRADRB2CHRM1DRD2ADRA2B | |
| Cinitapride SCHEMBL476454 | 0.84 | MLNR (1.00) | MLNRADRB2CHRM1DRD2ADRA2B | |
| Cinitapride SCHEMBL29453925 | 0.84 | MLNR (1.00) | MLNRADRB2CHRM1DRD2ADRA2B | |
| SCHEMBL19235643 | 0.80 | MLNR (0.86) | MLNRADRB2CHRM1DRD2ADRA2B | |
| Cinitapride SCHEMBL29692032 | 0.80 | DRD2 (0.90) | MLNRADRB2CHRM1DRD2ADRA2B | |
| Cinitapride SCHEMBL1229865 | 0.80 | DRD2 (0.90) | MLNRADRB2CHRM1DRD2ADRA2B | |
| SCHEMBL11946697 | 0.79 | MLNR (0.77) | MLNRADRB2CHRM1DRD2ADRA2B | |
| SCHEMBL9867256 | 0.79 | MLNR (0.84) | MLNRADRB2CHRM1DRD2ADRA2B | |
| SCHEMBL9865727 | 0.76 | MLNR (0.82) | MLNRADRB2CHRM1DRD2ADRA2B | |
| SCHEMBL13453078 | 0.76 | MLNR (0.71) | MLNRADRB2CHRM1DRD2ADRA2B |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20040241159-A1 | Serotonin receptor antagonists, analgesic (aspirin), and antiemitic; treating cephalic pain such as migraine, cluster headache, chronic paroxysmal hermicrania, headache associated with vascular disorders, headache associated with substances or their withdrawl, rebound headache and tension headache | GLAXO GROUP LIMITED (GB) | 2004-12-02 | — | — | US | disclosed |
| EP-1389131-A2 | COMBINATIONS OF A 5HT1 RECEPTOR AGONIST WITH AN ANALGESIC, AND AN ANTI-EMETIC AND/OR A GASTROPROKINETIC AGENT | GLAXO GROUP LIMITED (GB) | 2004-02-18 | — | — | EP | disclosed |
| WO-2002067987-A2 | COMBINATIONS OF A 5HT1 RECEPTOR AGONIST WITH AN ANALGESIC, AND AN ANTI-EMETIC AND/OR A GASTROPROKINETIC AGENT | GLAXO GROUP LIMITED (GB) | 2002-09-06 | — | — | WO | disclosed |