Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2A | P28223 | 2/20 | 0.70 |
| ▸ | HRH1 | P35367 | 2/20 | 0.70 |
| ▸ | SLC6A4 | P31645 | 10/20 | 0.61 |
| ▸ | SLC6A2 | P23975 | 7/20 | 0.54 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.54 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.49 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.46 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.46 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.46 |
| ▸ | HTR1A | P08908 | 1/20 | 0.46 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.46 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.46 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.46 |
| ▸ | SMPD1 | P17405 | 1/20 | 0.46 |
| ▸ | DRD1 | P21728 | 1/20 | 0.46 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.46 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.46 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.46 |
| ▸ | DRD3 | P35462 | 1/20 | 0.46 |
| ▸ | CASR | P41180 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| Delucemine SCHEMBL678708 | 0.97 | HTR2A (0.63) | HTR2AHRH1SLC6A4SLC6A2SLC6A3 | |
| Delucemine SCHEMBL1661363 | 0.95 | HTR2A (0.61) | HTR2AHRH1SLC6A4SLC6A2SLC6A3 | |
| Delucemine SCHEMBL1649904 | 0.93 | HTR2A (0.59) | HTR2AHRH1SLC6A4SLC6A2SLC6A3 | |
| SCHEMBL14415637 | 0.85 | SLC6A4 (0.60) | HTR2AHRH1SLC6A4SLC6A2CYP2D6 | |
| SCHEMBL14415664 | 0.84 | SLC6A4 (0.49) | HTR2AHRH1SLC6A4SLC6A2SLC6A3 | |
| SCHEMBL3638413 | 0.84 | HTR2A (1.00) | HTR2AHRH1SLC6A4SLC6A2SLC6A3 | |
| SCHEMBL14415663 | 0.82 | SLC6A4 (0.50) | HTR2AHRH1SLC6A4SLC6A2SLC6A3 | |
| Hydrochloric Acid SCHEMBL5223012 | 0.82 | HTR2A (0.95) | HTR2AHRH1SLC6A4SLC6A2SLC6A3 | |
| SCHEMBL14415613 | 0.81 | SLC6A4 (0.70) | HTR2AHRH1SLC6A4SLC6A2SLC6A3 | |
| SCHEMBL6050357 | 0.80 | SLC6A4 (0.54) | HTR2AHRH1SLC6A4SLC6A2SLC6A3 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7268166-B2 | Compounds active at a novel site on receptor-operated calcium channels useful for treatment of neurological disorders and diseases | NPS PHARMACEUTICALS, INC. (US) | 2007-09-11 | — | — | US | disclosed |
| US-7268166-B2 | Compounds active at a novel site on receptor-operated calcium channels useful for treatment of neurological disorders and diseases | NPS PHARMACEUTICALS, INC. (US) | 2007-09-11 | — | — | US | disclosed |
| EP-1096926-B1 | METHODS AND COMPOUNDS FOR TREATING DEPRESSION | NPS PHARMA INC (US) | 2007-02-28 | — | — | EP | disclosed |
| US-6750244-B2 | NERVOUS SYSTEM DISORDERS | NPS PHARMACEUTICALS, INC. | 2004-06-15 | — | — | US | disclosed |
| US-6211245-B1 | DRUGS FOR CONTROLLING CALCIUM MODULATORS | NPS PHARMACEUTICALS, INC. | 2001-04-03 | — | — | US | disclosed |