Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | QDPR | P09417 | 1/20 | 0.70 |
| ▸ | ERN1 | O75460 | 1/20 | 0.58 |
| ▸ | CHUK | O15111 | 1/20 | 0.56 |
| ▸ | CYP19A1 | P11511 | 4/20 | 0.53 |
| ▸ | CYP17A1 | P05093 | 3/20 | 0.53 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.53 |
| ▸ | CYP11B1 | P15538 | 3/20 | 0.53 |
| ▸ | CYP11B2 | P19099 | 3/20 | 0.53 |
| ▸ | PDE3B | Q13370 | 5/20 | 0.46 |
| ▸ | PDE3A | Q14432 | 5/20 | 0.46 |
| ▸ | APP | P05067 | 1/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 1/20 | 0.44 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.43 |
| ▸ | COMT | P21964 | 1/20 | 0.43 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | NPC1 | O15118 | 1/20 | 0.42 |
| ▸ | RAB9A | P51151 | 1/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL8385571 | 0.83 | QDPR (1.00) | QDPRERN1CHUKCYP19A1CYP17A1 | |
| Bromide SCHEMBL11332362 | 0.81 | QDPR (0.95) | QDPRERN1CHUKCYP19A1CYP17A1 | |
| SCHEMBL18311410 | 0.79 | ALOX5 (0.68) | APPLMNAMAPTALOX5HDAC1 | |
| SCHEMBL18311412 | 0.79 | ALOX5 (0.68) | APPLMNAMAPTALOX5HDAC1 | |
| SCHEMBL29923836 | 0.77 | QDPR (0.72) | QDPRERN1CHUKCYP19A1CYP17A1 | |
| SCHEMBL18311411 | 0.76 | ALOX5 (0.63) | CYP3A4APPLMNAMAPTALOX5 | |
| SCHEMBL23249858 | 0.74 | QDPR (0.57) | QDPRERN1CHUKCYP19A1CYP17A1 | |
| SCHEMBL11376011 | 0.73 | CYP3A4 (0.71) | QDPRERN1CHUKCYP19A1CYP17A1 | |
| SCHEMBL16841750 | 0.73 | QDPR (0.67) | QDPRERN1CHUKCYP19A1CYP17A1 | |
| SCHEMBL11258719 | 0.73 | QDPR (0.67) | QDPRERN1CHUKCYP19A1CYP17A1 |
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-3307256-B1 | HYDROXYLATED TROPOLONE INHIBITORS OF NUCLEOTIDYL TRANSFERASES IN HERPESVIRUS AND HEPATITIS B | UNIV SAINT LOUIS (US) | 2023-06-07 | — | — | EP | disclosed |
| WO-2016201243-A1 | HYDROXYLATED TROPOLONE INHIBITORS OF NUCLEOTIDYL TRANSFERASES IN HERPESVIRUS AND HEPATITS B AND USES THEREFOR | SAINT LOUIS UNIVERSITY (US) | 2016-12-15 | — | — | WO | disclosed |