Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.39 |
| ▸ | GABRA1 | P14867 | 3/20 | 0.38 |
| ▸ | GABRB2 | P47870 | 3/20 | 0.38 |
| ▸ | USP7 | Q93009 | 1/20 | 0.37 |
| ▸ | HEXA | P06865 | 2/20 | 0.36 |
| ▸ | HEXB | P07686 | 2/20 | 0.36 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.36 |
| ▸ | FFAR4 | Q5NUL3 | 2/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | SLC22A1 | O15245 | 1/20 | 0.36 |
| ▸ | DHFR | P00374 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | TP53 | P04637 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | HTR1A | P08908 | 1/20 | 0.36 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL3746992 | 0.73 | CYP2C19 (0.50) | ALDH1A1NPSR1SLC6A3FFAR4CYP1A2 | |
| SCHEMBL27579604 | 0.72 | ESR1 (0.46) | GABRA1GABRB2USP7 | |
| SCHEMBL10673076 | 0.72 | GABRA1 (0.54) | GABRA1GABRB2USP7MEN1KMT2A | |
| SCHEMBL28510720 | 0.72 | NR4A1 (0.51) | ALDH1A1NPSR1LMNACYP1A2CYP3A4 | |
| SCHEMBL7559810 | 0.71 | ALDH1A1 (0.40) | ALDH1A1NPSR1SLC6A3FFAR4CYP2C19 | |
| SCHEMBL29138316 | 0.71 | ELANE (0.45) | GCGRPPARGPPARA | |
| SCHEMBL10058354 | 0.71 | PTGS2 (0.52) | ALDH1A1SLC6A3FFAR4MEN1CYP1A2 | |
| SCHEMBL5009050 | 0.70 | SLC6A3 (0.55) | SLC6A3FFAR4MEN1TP53KMT2A | |
| SCHEMBL3022571 | 0.69 | GABRA1 (0.48) | ALDH1A1GABRA1GABRB2TDP1FFAR1 | |
| SCHEMBL2649847 | 0.69 | GCGR (0.48) | GCGRPPARGPPARA |
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-0934274-A1 | SUBSTITUTED PYRIDINES AND BIPHENYLS AS ANTI-HYPERCHOLESTERINEMIC, ANTI-HYPERLIPOPROTEINEMIC AND ANTI-HYPERGLYCEMIC AGENTS | Bayer Corporation (US) | 1999-08-11 | — | — | EP | disclosed |
| WO-1998004528-A2 | SUBSTITUTED PYRIDINES AND BIPHENYLS AS ANTI-HYPERCHOLESTERINEMIC, ANTI-HYPERLIPOPROTEINEMIC AND ANTI-HYPERGLYCEMIC AGENTS | BAYER CORPORATION (US) | 1998-02-05 | — | — | WO | disclosed |