Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2A | P28223 | 5/20 | 0.52 |
| ▸ | HTR2C | P28335 | 5/20 | 0.52 |
| ▸ | HTR2B | P41595 | 5/20 | 0.52 |
| ▸ | NOTUM | Q6P988 | 2/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.43 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.43 |
| ▸ | GFER | P55789 | 1/20 | 0.43 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.40 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.40 |
| ▸ | DRD2 | P14416 | 2/20 | 0.36 |
| ▸ | DRD4 | P21917 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.36 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.36 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.36 |
| ▸ | XIAP | P98170 | 1/20 | 0.36 |
| ▸ | BIRC2 | Q13490 | 1/20 | 0.36 |
| ▸ | HSD17B3 | P37058 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL7673508 | 0.83 | HTR2A (0.58) | HTR2AHTR2CHTR2BNOTUMLMNA | |
| Fumaric Acid SCHEMBL7676257 | 0.74 | HTR2A (0.81) | HTR2AHTR2CHTR2BNOTUMLMNA | |
| Fumaric Acid SCHEMBL7676268 | 0.74 | HTR2A (0.81) | HTR2AHTR2CHTR2BNOTUMLMNA | |
| SCHEMBL7673694 | 0.73 | HTR2A (0.54) | HTR2AHTR2CHTR2BNOTUMLMNA | |
| Fumaric Acid SCHEMBL7673702 | 0.73 | LMNA (0.51) | HTR2AHTR2CHTR2BNOTUMLMNA | |
| Fumaric Acid SCHEMBL7673519 | 0.72 | HTR2A (0.54) | HTR2AHTR2CHTR2BNOTUMLMNA | |
| Fumaric Acid SCHEMBL7676265 | 0.70 | HTR2A (0.52) | HTR2AHTR2CHTR2BNOTUMLMNA | |
| Fumaric Acid SCHEMBL7673698 | 0.70 | HTR2A (0.52) | HTR2AHTR2CHTR2BNOTUMLMNA | |
| SCHEMBL7679545 | 0.70 | LMNA (0.65) | HTR2AHTR2CHTR2BLMNAPMP22 | |
| SCHEMBL905975 | 0.69 | HTR2A (1.00) | HTR2AHTR2CHTR2BNOTUMLMNA |
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-6380238-B1 | FOR THERAPY OF DISORDERS OF THE CENTRAL NERVOUS SYSTEM; DAMAGE TO THE CENTRAL NERVOUS SYSTEM; CARDIOVASCULAR DISORDERS; GASTROINTESTINAL DISORDERS; DIABETES INSIPIDUS, AND SLEEP APNEA | VERNALIS RESEARCH LIMITED (GB) | 2002-04-30 | — | — | US | disclosed |
| EP-1109784-A1 | INDOLINE DERIVATIVES AS 5-HT2B AND/OR 5-HT2C RECEPTOR LIGANDS | VERNALIS RESEARCH LIMITED (GB) | 2001-06-27 | — | — | EP | disclosed |
| WO-2000012475-A1 | INDOLINE DERIVATIVES AS 5-HT2B AND/OR 5-HT2C RECEPTOR LIGANDS | VERNALIS RESEARCH LIMITED (GB) | 2000-03-09 | — | — | WO | disclosed |