Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 2/20 | 0.56 |
| ▸ | MEN1 | O00255 | 1/20 | 0.56 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.56 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.53 |
| ▸ | ADRA1D | P25100 | 4/20 | 0.53 |
| ▸ | ADRA1A | P35348 | 4/20 | 0.53 |
| ▸ | ADRA1B | P35368 | 4/20 | 0.53 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.50 |
| ▸ | HTR1A | P08908 | 3/20 | 0.49 |
| ▸ | DRD2 | P14416 | 1/20 | 0.49 |
| ▸ | HTR2A | P28223 | 1/20 | 0.48 |
| ▸ | HTR2C | P28335 | 1/20 | 0.48 |
| ▸ | HTR2B | P41595 | 1/20 | 0.48 |
| ▸ | HTR1D | P28221 | 1/20 | 0.48 |
| ▸ | HTR1B | P28222 | 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 | |
|---|---|---|---|---|
| SCHEMBL3692763 | 0.80 | CYP1A2 (0.54) | KMT2AMEN1ALDH1A1CYP2C9HTR1A | |
| SCHEMBL8550916 | 0.78 | MEN1 (0.55) | KMT2AMEN1ALDH1A1ADRA1DADRA1A | |
| SCHEMBL1537856 | 0.77 | KDM4E (0.55) | KMT2AALDH1A1CYP2C9DRD2 | |
| Ammonia Solution, Strong SCHEMBL27497850 | 0.76 | KDM4E (0.54) | KMT2AALDH1A1CYP2C9DRD2 | |
| SCHEMBL2905333 | 0.74 | OPRM1 (0.52) | KMT2AMEN1OPRM1HTR1ADRD2 | |
| SCHEMBL5364769 | 0.73 | CYP1A2 (0.49) | CYP2C9HTR1ADRD2HTR2AHTR2C | |
| SCHEMBL11109442 | 0.73 | HTR1A (0.63) | KMT2AMEN1ALDH1A1ADRA1DADRA1A | |
| Hydrochloric Acid SCHEMBL6017134 | 0.73 | HTR1A (0.56) | KMT2AMEN1ALDH1A1ADRA1DADRA1A | |
| SCHEMBL2766780 | 0.72 | ADRA1D (0.54) | KMT2AMEN1ALDH1A1OPRM1ADRA1D | |
| SCHEMBL2767637 | 0.72 | HTR1A (0.54) | KMT2AMEN1ALDH1A1ADRA1DADRA1A |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0660832-B1 | SEROTONIN RECEPTOR AGENTS | MERRELL PHARMA INC (US) | 1998-01-14 | — | — | EP | disclosed |
| US-5436246-A | Compounds for treatment of anxiety, depression, migraine, stroke, angina and hypertension | MERRELL DOW PHARMACEUTICALS INC. | 1995-07-25 | — | — | US | disclosed |
| EP-0660832-A1 | SEROTONIN RECEPTOR AGENTS | MERRELL PHARMACEUTICALS INC. (US) | 1995-07-05 | — | — | EP | disclosed |
| WO-1994006789-A1 | SEROTONIN RECEPTOR AGENTS | MERRELL DOW PHARMACEUTICALS INC. (US) | 1994-03-31 | — | — | WO | disclosed |