Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.51 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 2/20 | 0.40 |
| ▸ | KCNB1 | Q14721 | 1/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 2/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | GRM7 | Q14831 | 1/20 | 0.38 |
| ▸ | MCHR1 | Q99705 | 2/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.38 |
| ▸ | HPGDS | O60760 | 1/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | PPARD | Q03181 | 1/20 | 0.37 |
| ▸ | PPARA | Q07869 | 1/20 | 0.37 |
| ▸ | MRGPRX4 | Q96LA9 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL5057119 | 0.85 | KDM4E (0.69) | KDM4ETDP1TSHRCYP3A4ALDH1A1 | |
| SCHEMBL3372019 | 0.84 | KDM4E (0.51) | KDM4EL3MBTL1POLBKCNB1TDP1 | |
| SCHEMBL3372772 | 0.83 | TDP1 (0.58) | KDM4EL3MBTL1POLBKCNB1TDP1 | |
| SCHEMBL5052478 | 0.82 | KDM4E (0.56) | KDM4EL3MBTL1POLBTDP1TSHR | |
| SCHEMBL27051378 | 0.80 | TSHR (0.49) | KDM4EKCNB1TSHRCYP3A4ALDH1A1 | |
| SCHEMBL5051495 | 0.80 | KDM4E (0.49) | KDM4EL3MBTL1TDP1TSHRCYP3A4 | |
| SCHEMBL16809415 | 0.79 | MEN1 (0.49) | KDM4ETSHRALDH1A1HPGDSPPARD | |
| SCHEMBL5057172 | 0.78 | KDM4E (0.50) | KDM4EL3MBTL1POLBTDP1TSHR | |
| SCHEMBL5050037 | 0.78 | KDM4E (0.50) | KDM4EL3MBTL1POLBTDP1TSHR | |
| SCHEMBL5050100 | 0.77 | KDM4E (0.49) | KDM4EPOLBTDP1TSHRCYP3A4 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0539806-B1 | Thiadiazinones and medicines containing them, having in particular a positive inotropic and vasodilating activity | MERCK PATENT GMBH (DE) | 1995-01-04 | — | — | EP | disclosed |
| US-5276027-A | Thiadiazinones | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 1994-01-04 | — | — | US | disclosed |
| EP-0539806-A1 | Thiadiazinones and medicines containing them, having in particular a positive inotropic and vasodilating activity | MERCK PATENT GmbH (DE) | 1993-05-05 | — | — | EP | disclosed |