Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTT | P42858 | 2/20 | 0.40 |
| ▸ | MEN1 | O00255 | 3/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.36 |
| ▸ | TPMT | P51580 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | DDO | Q99489 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 2/20 | 0.33 |
| ▸ | GAA | P10253 | 2/20 | 0.33 |
| ▸ | HPGD | P15428 | 2/20 | 0.33 |
| ▸ | THRB | P10828 | 1/20 | 0.33 |
| ▸ | GFER | P55789 | 1/20 | 0.33 |
| ▸ | PLEC | Q15149 | 1/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.32 |
| ▸ | HCAR3 | P49019 | 4/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL12800309 | 0.89 | HTT (0.45) | HTTMEN1KMT2ATPMTKDM4E | |
| SCHEMBL15054181 | 0.77 | TPMT (0.41) | HTTMEN1KMT2ATPMTKDM4E | |
| SCHEMBL15054774 | 0.77 | TP53 (0.42) | HTTMEN1KMT2AMAPTGAA | |
| SCHEMBL5315788 | 0.76 | CYP1A2 (0.56) | HTTKMT2AKDM4EALDH1A1GAA | |
| SCHEMBL13460005 | 0.76 | HTT (0.39) | HTTMEN1KMT2ATPMTHPGD | |
| SCHEMBL6476384 | 0.75 | HTT (0.67) | HTTKMT2AKDM4EALDH1A1LMNA | |
| SCHEMBL15054145 | 0.74 | MAPT (0.53) | HTTMEN1KMT2ATPMTKDM4E | |
| SCHEMBL13380204 | 0.73 | PLA2G2A (0.41) | HTTMAPTGAAFOLH1PLA2G2A | |
| Butane SCHEMBL6727426 | 0.72 | TPMT (0.50) | HTTMEN1KMT2ATPMTKDM4E | |
| SCHEMBL28302239 | 0.71 | TPMT (0.42) | HTTMEN1KMT2ATPMTKDM4E |
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-2013096151-A1 | CHEMICAL COMPOUNDS | GLAXOSMITHKLINE LLC (US) | 2013-06-27 | — | — | WO | disclosed |