Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 3/20 | 0.47 |
| ▸ | CA2 | P00918 | 3/20 | 0.47 |
| ▸ | CA9 | Q16790 | 3/20 | 0.47 |
| ▸ | HTT | P42858 | 1/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.46 |
| ▸ | PPARG | P37231 | 3/20 | 0.45 |
| ▸ | LMNA | P02545 | 2/20 | 0.44 |
| ▸ | TSHR | P16473 | 1/20 | 0.44 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.44 |
| ▸ | ACHE | P22303 | 1/20 | 0.44 |
| ▸ | CXCR2 | P25025 | 2/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.41 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.41 |
| ▸ | CXCR1 | P25024 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.39 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.39 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.38 |
| ▸ | PGR | P06401 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL8821206 | 0.89 | CA1 (0.56) | CA1CA2CA9PPARGLMNA | |
| SCHEMBL780030 | 0.89 | CA1 (0.56) | CA1CA2CA9PPARGLMNA | |
| SCHEMBL2750188 | 0.88 | CA2 (0.57) | CA1CA2CA9HTTSMN1; SMN2 | |
| SCHEMBL27804335 | 0.87 | CA1 (0.54) | CA1CA2CA9PPARGLMNA | |
| SCHEMBL6923665 | 0.87 | CA1 (0.54) | CA1CA2CA9PPARGLMNA | |
| SCHEMBL1128833 | 0.87 | CA1 (0.54) | CA1CA2CA9PPARGLMNA | |
| SCHEMBL28043817 | 0.87 | CA1 (0.54) | CA1CA2CA9PPARGLMNA | |
| Methane SCHEMBL27573607 | 0.87 | CA1 (0.54) | CA1CA2CA9PPARGLMNA | |
| SCHEMBL28807949 | 0.87 | CA1 (0.54) | CA1CA2CA9PPARGLMNA | |
| Iodide SCHEMBL3347577 | 0.87 | CA1 (0.54) | CA1CA2CA9PPARGLMNA |
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 |
|---|---|---|---|---|---|---|---|
| CN-101774871-A | Method for preparing biaryl compound in pure water solution | UNIV DALIAN TECH | 2010-07-14 | — | — | CN | disclosed |