Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GABRA1 | P14867 | 5/20 | 0.44 |
| ▸ | GABRB2 | P47870 | 5/20 | 0.44 |
| ▸ | GAA | P10253 | 3/20 | 0.44 |
| ▸ | MEN1 | O00255 | 2/20 | 0.44 |
| ▸ | MAPT | P10636 | 2/20 | 0.44 |
| ▸ | CNR1 | P21554 | 2/20 | 0.44 |
| ▸ | CNR2 | P34972 | 2/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.44 |
| ▸ | ALDH2 | P05091 | 1/20 | 0.44 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.44 |
| ▸ | HPGD | P15428 | 1/20 | 0.44 |
| ▸ | PPARG | P37231 | 1/20 | 0.44 |
| ▸ | PPARD | Q03181 | 1/20 | 0.44 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.44 |
| ▸ | CYP11B1 | P15538 | 2/20 | 0.42 |
| ▸ | XDH | P47989 | 1/20 | 0.41 |
| ▸ | TNKS | O95271 | 1/20 | 0.41 |
| ▸ | PARP1 | P09874 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL8992683 | 0.88 | GAA (0.41) | GABRA1GABRB2GAAMEN1MAPT | |
| SCHEMBL9449606 | 0.84 | CYP11B1 (0.39) | GABRA1GABRB2GAAMEN1MAPT | |
| SCHEMBL9278177 | 0.76 | SMN1; SMN2 (0.50) | GABRA1GABRB2GAAMEN1MAPT | |
| SCHEMBL9283642 | 0.76 | ESR1 (0.38) | GABRA1GABRB2CYP11B1ESR1ESR2 | |
| SCHEMBL23319259 | 0.76 | KMO (0.46) | CYP11B1ESR1ESR2GABRA5GABRA3 | |
| SCHEMBL9449622 | 0.75 | RAB9A (0.56) | GAAMEN1MAPTKMT2AALDH1A1 | |
| SCHEMBL8992409 | 0.75 | RAB9A (0.56) | GAAMEN1MAPTKMT2AALDH1A1 | |
| SCHEMBL9556597 | 0.75 | GRM2 (0.39) | CYP11B1GABRA5GABRA3GRM2CYP2C9 | |
| SCHEMBL9259062 | 0.73 | GABRA1 (0.45) | GABRA1GABRB2GAAMEN1MAPT | |
| SCHEMBL8054086 | 0.73 | CYP11B1 (0.31) | GABRA1GABRB2GAAMEN1MAPT |
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-0433826-B1 | Fluorophenylpyridines | HOECHST AG (DE) | 1996-07-10 | — | — | EP | disclosed |
| US-5204476-A | For use in chiral tilted smectic liquid crystal phases | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 1993-04-20 | — | — | US | disclosed |
| EP-0433826-A2 | Fluorophenylpyridines | HOECHST AKTIENGESELLSCHAFT (DE) | 1991-06-26 | — | — | EP | disclosed |