Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LMNA | P02545 | 1/20 | 0.45 |
| ▸ | HTT | P42858 | 1/20 | 0.45 |
| ▸ | OPRM1 | P35372 | 5/20 | 0.40 |
| ▸ | CDK2 | P24941 | 2/20 | 0.39 |
| ▸ | CDK4 | P11802 | 1/20 | 0.39 |
| ▸ | CCNE1 | P24864 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 4/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.38 |
| ▸ | NPC1 | O15118 | 3/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 2/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | GFER | P55789 | 1/20 | 0.36 |
| ▸ | IDH1 | O75874 | 3/20 | 0.35 |
| ▸ | TRPV4 | Q9HBA0 | 3/20 | 0.35 |
| ▸ | COMT | P21964 | 1/20 | 0.34 |
| ▸ | TUBB4A | P04350 | 1/20 | 0.34 |
| ▸ | TUBB | P07437 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL578009 | 0.87 | OPRM1 (0.40) | LMNAHTTOPRM1CDK2CDK4 | |
| SCHEMBL3072583 | 0.83 | OPRM1 (0.38) | LMNAHTTOPRM1CDK2MEN1 | |
| SCHEMBL13147664 | 0.83 | ALDH1A1 (0.44) | LMNAHTTKMT2ANPC1RAB9A | |
| SCHEMBL13147670 | 0.82 | KDM4E (0.36) | HTTMEN1KMT2AKDM4EALDH1A1 | |
| SCHEMBL13147748 | 0.82 | IDH1 (0.36) | NPC1ALDH1A1MAPTGFERIDH1 | |
| SCHEMBL13147740 | 0.82 | IDH1 (0.41) | KMT2AKDM4EALDH1A1IDH1 | |
| SCHEMBL13147680 | 0.80 | PTGS2 (0.40) | LMNACDK2MAPTIDH1 | |
| SCHEMBL13147658 | 0.80 | IDH1 (0.36) | NPC1KDM4EALDH1A1MAPTGFER | |
| SCHEMBL13147672 | 0.79 | SRC (0.38) | CDK2NPC1ALDH1A1MAPTGFER | |
| SCHEMBL578105 | 0.79 | LMNA (0.39) | LMNAHTTOPRM1CDK2CDK4 |
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 |