Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP11B2 | P19099 | 3/20 | 0.36 |
| ▸ | KDM1A | O60341 | 1/20 | 0.36 |
| ▸ | MAOB | P27338 | 1/20 | 0.36 |
| ▸ | PTGDR2 | Q9Y5Y4 | 2/20 | 0.36 |
| ▸ | MEN1 | O00255 | 2/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | HPGD | P15428 | 2/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.36 |
| ▸ | CYP19A1 | P11511 | 3/20 | 0.35 |
| ▸ | DRD2 | P14416 | 2/20 | 0.35 |
| ▸ | DRD3 | P35462 | 2/20 | 0.35 |
| ▸ | CYP11B1 | P15538 | 2/20 | 0.35 |
| ▸ | KCNA5 | P22460 | 1/20 | 0.34 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.33 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL27450587 | 0.88 | CYP11B2 (0.35) | CYP11B2KDM1AMAOBPTGDR2MEN1 | |
| SCHEMBL10865420 | 0.85 | PTGS2 (0.36) | CYP11B2KDM1AMAOBCYP11B1 | |
| SCHEMBL10643121 | 0.85 | PTGS2 (0.36) | CYP11B2KDM1AMAOBCYP11B1 | |
| SCHEMBL28184495 | 0.80 | BRD4 (0.39) | CYP11B2PDK2CHRNB2CHRNA4 | |
| SCHEMBL4965411 | 0.80 | PTGDR2 (0.45) | CYP11B2KDM1AMAOBPTGDR2MEN1 | |
| SCHEMBL27626880 | 0.79 | PTGDR2 (0.50) | CYP11B2MAOBPTGDR2MEN1ALDH1A1 | |
| SCHEMBL28442339 | 0.79 | CNR1 (0.39) | CYP11B2KDM1AMAOBPTGDR2MEN1 | |
| SCHEMBL10490794 | 0.73 | DRD4 (0.40) | KMT2ADRD2SLC6A4 | |
| SCHEMBL10490787 | 0.73 | DRD4 (0.40) | KMT2ADRD2SLC6A4 | |
| SCHEMBL10634249 | 0.73 | PTGDR2 (0.43) | CYP11B2KDM1APTGDR2MEN1ALDH1A1 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0167912-A2 | Liquid crystal mixtures containing compounds with a 4-alkenyl or 2Z-alkenyl lateral chain | F. HOFFMANN-LA ROCHE AG (CH) | 1986-01-15 | — | — | EP | disclosed |