Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ABCB1 | P08183 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.33 |
| ▸ | RECQL | P46063 | 1/20 | 0.33 |
| ▸ | PAX8 | Q06710 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.32 |
| ▸ | TNFRSF1A | P19438 | 2/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | LCK | P06239 | 1/20 | 0.31 |
| ▸ | FYN | P06241 | 1/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
| ▸ | HTR1A | P08908 | 1/20 | 0.31 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.31 |
| ▸ | CYP2D6 | P10635 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL16465755 | 1.00 | ABCB1 (0.36) | ABCB1MAPTHPGDCYP3A4KDM4E | |
| SCHEMBL16462423 | 0.89 | ABCB1 (0.37) | ABCB1CYP3A4KDM4ENPSR1RECQL | |
| SCHEMBL16462426 | 0.89 | ABCB1 (0.37) | ABCB1CYP3A4KDM4ENPSR1RECQL | |
| SCHEMBL16461663 | 0.83 | MAPT (0.40) | ABCB1MAPTHPGDCYP3A4KDM4E | |
| SCHEMBL16461664 | 0.83 | MAPT (0.40) | ABCB1MAPTHPGDCYP3A4KDM4E | |
| SCHEMBL16462243 | 0.75 | CYP3A4 (0.35) | CYP3A4KDM4ENPSR1PAX8LMNA | |
| SCHEMBL16462241 | 0.75 | CYP3A4 (0.35) | CYP3A4KDM4ENPSR1PAX8LMNA | |
| SCHEMBL18240186 | 0.75 | MAPT (0.34) | ABCB1MAPTHPGDCYP3A4KDM4E | |
| SCHEMBL18240184 | 0.75 | MAPT (0.34) | ABCB1MAPTHPGDCYP3A4KDM4E | |
| SCHEMBL18627854 | 0.75 | MAPT (0.34) | ABCB1MAPTHPGDCYP3A4KDM4E |
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-2906540-A1 | AN IMPROVED PRODUCTION METHOD AND NEW INTERMEDIATES OF SYNTHESIS OF ELVITEGRAVIR | Zentiva K.S. (CZ) | 2015-08-19 | — | — | EP | disclosed |
| WO-2014056465-A1 | AN IMPROVED PRODUCTION METHOD AND NEW INTERMEDIATES OF SYNTHESIS OF ELVITEGRAVIR | ZENTIVA, K.S. (CZ) | 2014-04-17 | — | — | WO | disclosed |