Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | APLNR | P35414 | 1/20 | 0.37 |
| ▸ | FFAR3 | O14843 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.35 |
| ▸ | GRM4 | Q14833 | 4/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.34 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.34 |
| ▸ | GRM8 | O00222 | 1/20 | 0.34 |
| ▸ | GRM6 | O15303 | 1/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | GRM2 | Q14416 | 1/20 | 0.33 |
| ▸ | GRM3 | Q14832 | 1/20 | 0.33 |
| ▸ | SLC6A4 | P31645 | 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 | |
|---|---|---|---|---|
| SCHEMBL11518296 | 1.00 | APLNR (0.37) | APLNRFFAR3CYP2C19GRM4CYP1A2 | |
| SCHEMBL6268424 | 0.81 | APLNR (0.34) | APLNRFFAR3CYP2C19GRM4CYP1A2 | |
| SCHEMBL9748351 | 0.78 | SMN1; SMN2 (0.33) | ALDH1A1KMT2A | |
| SCHEMBL14783304 | 0.77 | CYP2C19 (0.36) | APLNRCYP2C19GRM4CYP1A2ALDH1A1 | |
| SCHEMBL21410922 | 0.75 | CYP2C19 (0.35) | APLNRCYP2C19GRM4CYP1A2ALDH1A1 | |
| SCHEMBL22396496 | 0.75 | CYP2C19 (0.35) | APLNRCYP2C19GRM4CYP1A2ALDH1A1 | |
| SCHEMBL7003944 | 0.75 | CYP2C19 (0.35) | APLNRCYP2C19GRM4CYP1A2ALDH1A1 | |
| SCHEMBL248541 | 0.75 | CYP2C19 (0.35) | APLNRCYP2C19GRM4CYP1A2ALDH1A1 | |
| SCHEMBL21410715 | 0.75 | CYP2C19 (0.35) | APLNRCYP2C19GRM4CYP1A2ALDH1A1 | |
| SCHEMBL248944 | 0.75 | CYP2C19 (0.35) | APLNRCYP2C19GRM4CYP1A2ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2020028150-A1 | INHIBITORS OF HISTONE DEACETYLASE USEFUL FOR THE TREATMENT OR PREVENTION OF HIV INFECTION | MERCK SHARP & DOHME CORP. (US) | 2020-02-06 | — | — | WO | disclosed |
| WO-2019051396-A1 | SMALL MOLECULE INHIBITORS OF EBOLA AND LASSA FEVER VIRUSES AND METHODS OF USE | PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) | 2019-03-14 | — | — | WO | disclosed |