Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR1B | P28222 | 3/20 | 0.50 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.47 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.47 |
| ▸ | LMNA | P02545 | 3/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | RAD52 | P43351 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.41 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.40 |
| ▸ | DRD2 | P14416 | 1/20 | 0.40 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.40 |
| ▸ | CNR1 | P21554 | 1/20 | 0.40 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.40 |
| ▸ | HTR2A | P28223 | 1/20 | 0.40 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.40 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.40 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL10391191 | 0.95 | HTR1B (0.49) | HTR1BCYP1A2CYP2C19CYP2D6LMNA | |
| SCHEMBL18243028 | 0.81 | CYP2C19 (0.44) | CYP1A2CYP2C19CYP2D6HTTCYP2C9 | |
| SCHEMBL10390339 | 0.79 | CYP2C19 (0.55) | HTR1BCYP1A2CYP2C19CYP2D6LMNA | |
| SCHEMBL18242791 | 0.77 | CYP2C19 (0.47) | CYP1A2CYP2C19CYP2D6LMNANR1I2 | |
| SCHEMBL4006370 | 0.77 | CYP1A2 (0.56) | HTR1BCYP1A2CYP2C19CYP2D6LMNA | |
| Hydrochloric Acid SCHEMBL25415894 | 0.76 | HTR1B (0.54) | HTR1BCYP1A2CYP2C19CYP2D6LMNA | |
| Hydrochloric Acid SCHEMBL25414990 | 0.76 | HTR1B (0.54) | HTR1BCYP1A2CYP2C19CYP2D6LMNA | |
| Hydrochloric Acid SCHEMBL25416546 | 0.76 | HTR1B (0.54) | HTR1BCYP1A2CYP2C19CYP2D6LMNA | |
| Water SCHEMBL11573030 | 0.76 | HTR1B (0.54) | HTR1BCYP1A2CYP2C19CYP2D6LMNA | |
| Water SCHEMBL11571498 | 0.76 | HTR1B (0.54) | HTR1BCYP1A2CYP2C19CYP2D6LMNA |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1392315-A1 | METHODS OF TREATING ALZHEIMER'S DISEASE | Elan Pharmaceuticals, Inc. (US) | 2004-03-03 | — | — | EP | disclosed |
| WO-2002100410-A1 | METHODS OF TREATING ALZHEIMER'S DISEASE | ELAN PHARMACEUTICALS, INC. (US) | 2002-12-19 | — | — | WO | disclosed |