Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.44 |
| ▸ | NPC1 | O15118 | 7/20 | 0.42 |
| ▸ | RAB9A | P51151 | 7/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.42 |
| ▸ | MAPT | P10636 | 4/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.42 |
| ▸ | HPGD | P15428 | 2/20 | 0.42 |
| ▸ | HCAR3 | P49019 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 2/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.41 |
| ▸ | AGTR1 | P30556 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | GAA | P10253 | 2/20 | 0.40 |
| ▸ | HTT | P42858 | 3/20 | 0.40 |
| ▸ | ATM | Q13315 | 1/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.39 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.39 |
| ▸ | HTR3A | P46098 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL28585105 | 0.85 | PDE10A (0.47) | PDE10ANPC1RAB9AKDM4EMAPT | |
| Hydrochloric Acid SCHEMBL28608866 | 0.84 | PDE10A (0.46) | PDE10ANPC1RAB9AKDM4EMAPT | |
| SCHEMBL26149036 | 0.79 | ESR2 (0.41) | PDE10AMAPTALDH1A1HCAR3MEN1 | |
| SCHEMBL13701721 | 0.78 | NCF1 (0.60) | NPC1RAB9AMAPTHCAR3MEN1 | |
| SCHEMBL26677368 | 0.78 | KDM4E (0.43) | PDE10ANPC1RAB9AKDM4EMAPT | |
| SCHEMBL7048629 | 0.75 | NCF1 (0.55) | PDE10ANPC1RAB9AKDM4EMAPT | |
| SCHEMBL9131395 | 0.74 | CYP1A2 (0.50) | RAB9AKDM4EMAPTALDH1A1HPGD | |
| Hydrochloric Acid SCHEMBL28590788 | 0.73 | NCF1 (0.53) | PDE10ANPC1RAB9AKDM4EMAPT | |
| SCHEMBL28679814 | 0.72 | KDM4E (0.45) | PDE10ANPC1RAB9AKDM4EMAPT | |
| SCHEMBL5435508 | 0.72 | RAB9A (0.49) | PDE10ANPC1RAB9AKDM4EMAPT |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2007027532-A2 | NIACIN RECEPTOR AGONISTS, COMPOSITIONS CONTAINING SUCH COMPOUNDS AND METHODS OF TREATMENT | MERCK & CO., INC. (US) | 2007-03-08 | — | — | WO | disclosed |