Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 4/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.37 |
| ▸ | HPGD | P15428 | 1/20 | 0.37 |
| ▸ | NPY1R | P25929 | 1/20 | 0.37 |
| ▸ | NPY2R | P49146 | 1/20 | 0.37 |
| ▸ | EPHX2 | P34913 | 2/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.36 |
| ▸ | FAAH | O00519 | 4/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 3/20 | 0.36 |
| ▸ | SLC5A1 | P13866 | 4/20 | 0.36 |
| ▸ | LMNA | P02545 | 2/20 | 0.36 |
| ▸ | MAPT | P10636 | 2/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 3/20 | 0.35 |
| ▸ | NPC1 | O15118 | 2/20 | 0.35 |
| ▸ | XBP1 | P17861 | 2/20 | 0.35 |
| ▸ | S1PR2 | O95136 | 1/20 | 0.35 |
| ▸ | NR2F2 | P24468 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL1132015 | 1.00 | MEN1 (0.37) | MEN1ALDH1A1KMT2AKDM4EHPGD | |
| SCHEMBL12860131 | 0.88 | FAAH (0.37) | ALDH1A1HPGDEPHX2SMN1; SMN2FAAH | |
| SCHEMBL1131659 | 0.86 | PTPN1 (0.47) | ALDH1A1SMN1; SMN2MAPTRAB9ANPC1 | |
| SCHEMBL1132051 | 0.86 | PTPN1 (0.47) | ALDH1A1SMN1; SMN2MAPTRAB9ANPC1 | |
| SCHEMBL1131260 | 0.85 | SLC5A1 (0.39) | EPHX2SLC5A1 | |
| SCHEMBL1131557 | 0.79 | FAAH (0.40) | MEN1ALDH1A1KMT2AKDM4EHPGD | |
| SCHEMBL1131559 | 0.79 | FAAH (0.40) | MEN1ALDH1A1KMT2AKDM4EHPGD | |
| SCHEMBL1132020 | 0.77 | PTGS2 (0.42) | ALDH1A1FAAHMAPK1 | |
| SCHEMBL1132017 | 0.77 | PTGS2 (0.42) | ALDH1A1FAAHMAPK1 | |
| SCHEMBL12860128 | 0.76 | FAAH (0.39) | MEN1ALDH1A1KMT2AKDM4EHPGD |
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-1663105-B1 | CYCLOALKYL HETEROCYCLES FOR TREATING HEPATITIS C VIRUS | BRISTOL MYERS SQUIBB CO (US) | 2011-02-16 | — | — | EP | disclosed |
| EP-1663105-B1 | CYCLOALKYL HETEROCYCLES FOR TREATING HEPATITIS C VIRUS | BRISTOL MYERS SQUIBB CO (US) | 2011-02-16 | — | — | EP | disclosed |