Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | P2RX7 | Q99572 | 5/20 | 0.37 |
| ▸ | DAO | P14920 | 1/20 | 0.37 |
| ▸ | EZH2 | Q15910 | 9/20 | 0.37 |
| ▸ | HTR2A | P28223 | 1/20 | 0.37 |
| ▸ | GRM2 | Q14416 | 1/20 | 0.37 |
| ▸ | TNIK | Q9UKE5 | 1/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 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 | |
|---|---|---|---|---|
| SCHEMBL4486283 | 1.00 | P2RX7 (0.37) | P2RX7DAOEZH2HTR2AGRM2 | |
| SCHEMBL4478453 | 0.86 | DAO (0.39) | DAOEZH2HTR2AGRM2TNIK | |
| SCHEMBL1336948 | 0.86 | AKR1B1 (0.38) | P2RX7DAOEZH2HTR2AGRM2 | |
| SCHEMBL4492829 | 0.84 | AKR1B1 (0.35) | P2RX7DAOEZH2HTR2AGRM2 | |
| SCHEMBL4484368 | 0.83 | MEN1 (0.39) | EZH2ALDH1A1LMNAHTTSMN1; SMN2 | |
| SCHEMBL4482140 | 0.83 | P2RX7 (0.39) | P2RX7EZH2HTR2AGRM2ALDH1A1 | |
| SCHEMBL4486261 | 0.78 | P2RX7 (0.37) | P2RX7EZH2HTR2AGRM2ALDH1A1 | |
| SCHEMBL4479378 | 0.77 | EZH2 (0.37) | P2RX7EZH2HTR2AGRM2ALDH1A1 | |
| SCHEMBL3023303 | 0.77 | EZH2 (0.32) | EZH2HTR2AGRM2 | |
| SCHEMBL1336823 | 0.77 | EZH2 (0.32) | EZH2HTR2AGRM2 |
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-1725556-A1 | HIV INTEGRASE INHIBITORS | Merck & Co., Inc. (US) | 2006-11-29 | — | — | EP | disclosed |
| WO-2005087768-A1 | HIV INTEGRASE INHIBITORS | MERCK & CO., INC. (US) | 2005-09-22 | — | — | WO | disclosed |