Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE2A | O00408 | 1/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.35 |
| ▸ | POLB | P06746 | 5/20 | 0.35 |
| ▸ | MAPT | P10636 | 2/20 | 0.35 |
| ▸ | ATM | Q13315 | 1/20 | 0.35 |
| ▸ | CYP19A1 | P11511 | 2/20 | 0.34 |
| ▸ | NOX1 | Q9Y5S8 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 2/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.33 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | APP | P05067 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 4/20 | 0.33 |
| ▸ | NPC1 | O15118 | 3/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL11926434 | 0.86 | PDE2A (0.35) | PDE2AKDM4EPOLBMAPTATM | |
| SCHEMBL13148388 | 0.85 | CYP19A1 (0.39) | PDE2AKDM4EPOLBMAPTATM | |
| SCHEMBL13148387 | 0.83 | NPC1 (0.43) | PDE2AKDM4EMAPTCYP19A1LMNA | |
| SCHEMBL13147612 | 0.82 | PDE2A (0.38) | PDE2AKDM4EPOLBMAPTATM | |
| SCHEMBL13148391 | 0.80 | PDE2A (0.40) | PDE2AKDM4EPOLBMAPTATM | |
| SCHEMBL13147613 | 0.80 | CYP19A1 (0.41) | PDE2AKDM4EPOLBMAPTCYP19A1 | |
| SCHEMBL13147610 | 0.79 | PDE2A (0.40) | PDE2AKDM4EPOLBMAPTATM | |
| SCHEMBL13148392 | 0.79 | BRD4 (0.40) | PDE2APOLBLMNACYP1A2CYP3A4 | |
| SCHEMBL13147687 | 0.77 | PDE2A (0.39) | PDE2AKDM4EPOLBMAPTATM | |
| SCHEMBL13147759 | 0.77 | CSF1R (0.49) | PDE2AKDM4ERAB9AALDH1A1TDP1 |
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-2010118078-A1 | MACROCYCLIC SERINE PROTEASE INHIBITORS | IDENIX PHARMACEUTICALS, INC. (US) | 2010-10-14 | — | — | WO | disclosed |