Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2A6 | P11509 | 3/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | MAPT | P10636 | 2/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | ERN1 | O75460 | 2/20 | 0.39 |
| ▸ | NCEH1 | Q6PIU2 | 1/20 | 0.34 |
| ▸ | BACE1 | P56817 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 3/20 | 0.32 |
| ▸ | PKM | P14618 | 1/20 | 0.32 |
| ▸ | DHODH | Q02127 | 1/20 | 0.32 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.32 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.32 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.32 |
| ▸ | NPC1 | O15118 | 1/20 | 0.31 |
| ▸ | RAB9A | P51151 | 1/20 | 0.31 |
| ▸ | ATM | Q13315 | 1/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.31 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL1701106 | 0.82 | UGT2B7 (0.47) | CYP2A6MEN1KMT2AATM | |
| SCHEMBL20299625 | 0.82 | UGT2B7 (0.47) | CYP2A6MEN1KMT2AATM | |
| SCHEMBL2479755 | 0.79 | CYP2A6 (0.42) | CYP2A6ALDH1A1MAPTKDM4EMEN1 | |
| SCHEMBL22590138 | 0.79 | CYP2A6 (0.40) | CYP2A6ALDH1A1MEN1KMT2ASMN1; SMN2 | |
| SCHEMBL321965 | 0.79 | CYP2A6 (0.40) | CYP2A6ALDH1A1MEN1KMT2ASMN1; SMN2 | |
| SCHEMBL27865081 | 0.77 | CYP2A6 (0.39) | CYP2A6ALDH1A1MAPTKDM4EMEN1 | |
| SCHEMBL5504556 | 0.77 | AKR1C3 (0.53) | CYP2A6MAPTKDM4ELMNAL3MBTL1 | |
| SCHEMBL12492235 | 0.76 | CYP1A2 (0.41) | ERN1BACE1 | |
| SCHEMBL540882 | 0.76 | ALDH1A1 (0.47) | ALDH1A1 | |
| SCHEMBL21495049 | 0.76 | ALDH1A1 (0.47) | ALDH1A1 |
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 14 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2797913-A1 | QUINAZOLINONE DERIVATIVES AS HCV INHIBITORS | Janssen R&D Ireland (IE) | 2014-11-05 | — | — | EP | disclosed |
| EP-2640719-A2 | ANTIVIRAL COMPOUNDS | Gilead Sciences, Inc. (US) | 2013-09-25 | — | — | EP | disclosed |
| WO-2013098320-A1 | QUINAZOLINONE DERIVATIVES AS HCV INHIBITORS | JANSSEN R&D IRELAND (IE) | 2013-07-04 | — | — | WO | disclosed |
| EP-2598498-A1 | HETERO-BICYCLIC DERIVATIVES AS HCV INHIBITORS | Janssen R&D Ireland (IE) | 2013-06-05 | — | — | EP | disclosed |
| WO-2012123298-A1 | ANTIVIRAL COMPOUNDS | F. HOFFMANN-LA ROCHE AG (CH) | 2012-09-20 | — | — | WO | disclosed |
| EP-2499127-A1 | HEPATITIS C VIRUS INHIBITORS | Bristol-Myers Squibb Company (US) | 2012-09-19 | — | — | EP | disclosed |
| EP-2499115-A1 | HEPATITIS C VIRUS INHIBITORS | Bristol-Myers Squibb Company (US) | 2012-09-19 | — | — | EP | disclosed |
| EP-2496572-A1 | BENZIMIDAZOLE-IMIDAZOLE DERIVATIVES | Janssen R&D Ireland (IE) | 2012-09-12 | — | — | EP | disclosed |
| WO-2012068234-A2 | ANTIVIRAL COMPOUNDS | GILEAD SCIENCES, INC. (US) | 2012-05-24 | — | — | WO | disclosed |
| WO-2012013643-A1 | HETERO-BICYCLIC DERIVATIVES AS HCV INHIBITORS | TIBOTEC PHARMACEUTICALS (IE) | 2012-02-02 | — | — | WO | disclosed |
| WO-2011091446-A1 | CHEMICAL COMPOUNDS | GLAXOSMITHKLINE LLC (US) | 2011-07-28 | — | — | WO | disclosed |
| WO-2011059887-A1 | HEPATITIS C VIRUS INHIBITORS | BRISTOL-MYERS SQUIBB COMPANY (US) | 2011-05-19 | — | — | WO | disclosed |
| WO-2011059850-A1 | HEPATITIS C VIRUS INHIBITORS | BRISTOL-MYERS SQUIBB COMPANY (US) | 2011-05-19 | — | — | WO | disclosed |
| WO-2011054834-A1 | BENZIMIDAZOLE-IMIDAZOLE DERIVATIVES | TIBOTEC PHARMACEUTICALS (IE) | 2011-05-12 | — | — | WO | disclosed |