Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDR | P35968 | 1/20 | 0.69 |
| ▸ | CNR2 | P34972 | 1/20 | 0.64 |
| ▸ | AR | P10275 | 2/20 | 0.63 |
| ▸ | PGR | P06401 | 1/20 | 0.63 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.63 |
| ▸ | PDK1 | Q15118 | 1/20 | 0.62 |
| ▸ | GRM4 | Q14833 | 1/20 | 0.56 |
| ▸ | LMNA | P02545 | 3/20 | 0.55 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.54 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.54 |
| ▸ | CA1 | P00915 | 1/20 | 0.54 |
| ▸ | CA2 | P00918 | 1/20 | 0.54 |
| ▸ | CA7 | P43166 | 1/20 | 0.54 |
| ▸ | CA9 | Q16790 | 1/20 | 0.54 |
| ▸ | MEN1 | O00255 | 1/20 | 0.54 |
| ▸ | HTT | P42858 | 1/20 | 0.54 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.54 |
| ▸ | TMPRSS4 | Q9NRS4 | 1/20 | 0.54 |
| ▸ | KCNJ5 | P48544 | 1/20 | 0.54 |
| ▸ | KCNJ3 | P48549 | 1/20 | 0.54 |
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 | |
|---|---|---|---|---|
| SCHEMBL1291336 | 0.89 | KDR (0.71) | KDRCNR2PDK1GRM4LMNA | |
| SCHEMBL29625148 | 0.89 | KDR (0.71) | KDRCNR2PDK1GRM4LMNA | |
| SCHEMBL29625146 | 0.89 | KDR (0.71) | KDRCNR2PDK1GRM4LMNA | |
| SCHEMBL8409965 | 0.88 | KDR (0.69) | KDRCNR2PDK1GRM4LMNA | |
| SCHEMBL31531550 | 0.87 | KDR (0.64) | KDRCNR2PDK1GRM4LMNA | |
| SCHEMBL31495074 | 0.86 | KDR (0.76) | KDRCNR2PDK1GRM4LMNA | |
| SCHEMBL12712751 | 0.85 | AR (0.73) | KDRCNR2ARPDK1LMNA | |
| SCHEMBL3645017 | 0.84 | KDR (0.73) | KDRCNR2PDK1GRM4LMNA | |
| SCHEMBL21654202 | 0.84 | KDR (0.64) | KDRCNR2PDK1GRM4LMNA | |
| SCHEMBL4123404 | 0.83 | AR (0.64) | KDRCNR2ARPGRCYP3A4 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5994362-A | ADMINISTERING FINASTERIDE AND CASODEX | MERCK & CO., INC. (US) | 1999-11-30 | — | — | US | disclosed |
| EP-0514056-A2 | Use of estrogens or antiandrogens for reversal of male sexual phenotype in poultry | MERCK & CO. INC. (US) | 1992-11-19 | — | — | EP | disclosed |
| WO-1992016233-A1 | PHARMACEUTICAL COMBINATION FOR THE TREATMENT OF PROSTATIC CANCER CONTAINING A 5 ALPHA REDUCTASE INHIBITOR AND AN ANTIANDROGEN | MERCK & CO., INC. (US) | 1992-10-01 | — | — | WO | disclosed |