Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EPHX1 | P07099 | 1/20 | 0.56 |
| ▸ | NAAA | Q02083 | 1/20 | 0.50 |
| ▸ | FAAH | O00519 | 1/20 | 0.46 |
| ▸ | ACHE | P22303 | 7/20 | 0.46 |
| ▸ | TSHR | P16473 | 3/20 | 0.46 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.43 |
| ▸ | RAD52 | P43351 | 1/20 | 0.43 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | DGKA | P23743 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL15799852 | 1.00 | EPHX1 (0.56) | EPHX1NAAAFAAHACHETSHR | |
| Hydrochloric Acid SCHEMBL15796615 | 0.98 | EPHX1 (0.55) | EPHX1NAAAFAAHACHETSHR | |
| SCHEMBL4763694 | 0.92 | ALDH1A1 (0.48) | EPHX1NAAAFAAHACHETSHR | |
| SCHEMBL4763677 | 0.84 | HCAR2 (0.36) | EPHX1ACHETSHRHCAR2ALDH1A1 | |
| Hydrochloric Acid SCHEMBL8844741 | 0.84 | EPHX1 (0.50) | EPHX1NAAAFAAHACHETSHR | |
| SCHEMBL2725200 | 0.84 | EPHX1 (0.50) | EPHX1NAAAFAAHACHETSHR | |
| Bromide SCHEMBL10571114 | 0.82 | EPHX1 (0.49) | EPHX1NAAAFAAHACHETSHR | |
| Hydrochloric Acid SCHEMBL3466456 | 0.82 | EPHX1 (0.49) | EPHX1NAAAFAAHACHETSHR | |
| SCHEMBL7936152 | 0.80 | NAAA (0.57) | EPHX1NAAAFAAHACHETSHR | |
| SCHEMBL417576 | 0.80 | NAAA (0.57) | EPHX1NAAAFAAHACHETSHR |
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-2017106069-A1 | ANTIVIRAL OXIME PHOSPHORAMIDE COMPOUNDS | MERCK SHARP & DOHME CORP. (US) | 2017-06-22 | — | — | WO | disclosed |