Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.63 |
| ▸ | HPGD | P15428 | 3/20 | 0.63 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.63 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.63 |
| ▸ | HTT | P42858 | 1/20 | 0.63 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.48 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.48 |
| ▸ | TSHR | P16473 | 1/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.44 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.42 |
| ▸ | NR5A1 | Q13285 | 1/20 | 0.41 |
| ▸ | ACACB | O00763 | 3/20 | 0.40 |
| ▸ | MGLL | Q99685 | 1/20 | 0.40 |
| ▸ | HSD11B1 | P28845 | 3/20 | 0.39 |
| ▸ | HSD11B2 | P80365 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL13347699 | 0.98 | ALDH1A1 (0.61) | ALDH1A1HPGDKDM4EL3MBTL1HTT | |
| SCHEMBL27291360 | 0.93 | KDM4E (0.58) | ALDH1A1HPGDKDM4EL3MBTL1HTT | |
| SCHEMBL7433167 | 0.88 | ALDH1A1 (0.49) | ALDH1A1HPGDKDM4EL3MBTL1HTT | |
| SCHEMBL22120122 | 0.85 | ALDH1A1 (0.57) | ALDH1A1HPGDKDM4EL3MBTL1HTT | |
| SCHEMBL17233335 | 0.84 | KDM4E (0.46) | ALDH1A1HPGDKDM4EL3MBTL1HTT | |
| SCHEMBL11308751 | 0.84 | CYP3A4 (0.48) | ALDH1A1HPGDKDM4EL3MBTL1HTT | |
| SCHEMBL9710156 | 0.84 | CYP3A4 (0.48) | ALDH1A1HPGDKDM4EL3MBTL1HTT | |
| SCHEMBL17088421 | 0.84 | CYP3A4 (0.48) | ALDH1A1HPGDKDM4EL3MBTL1HTT | |
| SCHEMBL11315003 | 0.84 | CYP3A4 (0.48) | ALDH1A1HPGDKDM4EL3MBTL1HTT | |
| SCHEMBL24340323 | 0.83 | ALDH1A1 (0.50) | ALDH1A1HPGDKDM4EL3MBTL1HTT |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0639189-B1 | PYRIDYLPYRIMIDINES, A METHOD OF PREPARING THEM, AND THEIR USE IN LIQUID-CRYSTAL MIXTURES | AVENTIS RES & TECH GMBH & CO (DE) | 2003-02-19 | — | — | EP | disclosed |
| US-5464865-A | Enzyme inhibitors as antiinflammatory agents | ORTHO PHARMACEUTICAL CORPORATION (US) | 1995-11-07 | — | — | US | disclosed |
| US-5443754-A | Pyridylpyrimidines, a process for their preparation and their use in liquid-crystalline mixtures | HOECHST AKTIENGESELLSCHAFT (DE) | 1995-08-22 | — | — | US | disclosed |
| EP-0639189-A1 | PYRIDYLPYRIMIDINES, A METHOD OF PREPARING THEM, AND THEIR USE IN LIQUID-CRYSTAL MIXTURES | HOECHST AKTIENGESELLSCHAFT (DE) | 1995-02-22 | — | — | EP | disclosed |
| EP-0639189-A4 | PYRIDYLPYRIMIDINES, A METHOD OF PREPARING THEM, AND THEIR USE IN LIQUID-CRYSTAL MIXTURES. | AVENTIS RES & TECH GMBH & CO (DE) | 1993-09-17 | — | — | EP | disclosed |
| WO-1992012974-A1 | PYRIDYLPYRIMIDINES, A METHOD OF PREPARING THEM, AND THEIR USE IN LIQUID-CRYSTAL MIXTURES | HOECHST AKTIENGESELLSCHAFT (DE) | 1992-08-06 | — | — | WO | disclosed |