Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EPHX1 | P07099 | 4/20 | 0.46 |
| ▸ | CES2 | O00748 | 1/20 | 0.38 |
| ▸ | CES1 | P23141 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | PSEN1 | P49768 | 3/20 | 0.33 |
| ▸ | PSEN2 | P49810 | 3/20 | 0.33 |
| ▸ | APH1B | Q8WW43 | 3/20 | 0.33 |
| ▸ | NCSTN | Q92542 | 3/20 | 0.33 |
| ▸ | APH1A | Q96BI3 | 3/20 | 0.33 |
| ▸ | PSENEN | Q9NZ42 | 3/20 | 0.33 |
| ▸ | TP53 | P04637 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL2617042 | 1.00 | EPHX1 (0.46) | EPHX1CES2CES1KDM4EHTT | |
| SCHEMBL22872257 | 1.00 | EPHX1 (0.46) | EPHX1CES2CES1KDM4EHTT | |
| SCHEMBL18735714 | 1.00 | EPHX1 (0.46) | EPHX1CES2CES1KDM4EHTT | |
| SCHEMBL25574876 | 0.93 | EPHX1 (0.40) | EPHX1CES2CES1KDM4EHTT | |
| SCHEMBL13872421 | 0.93 | EPHX1 (0.40) | EPHX1CES2CES1KDM4EHTT | |
| SCHEMBL28004056 | 0.91 | EPHX1 (0.41) | EPHX1CES2CES1KDM4EHTT | |
| SCHEMBL18532477 | 0.90 | EPHX1 (0.39) | EPHX1KDM4EHTTSMN1; SMN2PSEN1 | |
| SCHEMBL1115372 | 0.89 | KDM4E (0.47) | KDM4EHTTSMN1; SMN2 | |
| SCHEMBL18435274 | 0.89 | KDM4E (0.47) | KDM4EHTTSMN1; SMN2 | |
| SCHEMBL16141882 | 0.89 | KDM4E (0.47) | KDM4EHTTSMN1; SMN2 |
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-2017205309-A1 | INSULIN RECEPTOR PARTIAL AGONISTS | MERCK SHARP & DOHME CORP. (US) | 2017-11-30 | — | — | WO | disclosed |