Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.57 |
| ▸ | GRM8 | O00222 | 3/20 | 0.56 |
| ▸ | GRM4 | Q14833 | 3/20 | 0.56 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.51 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.51 |
| ▸ | PTPRA | P18433 | 1/20 | 0.48 |
| ▸ | KMO | O15229 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL2818968 | 0.96 | CYP1A2 (0.56) | CYP1A2GRM8GRM4ALDH1A1TDP1 | |
| SCHEMBL1817774 | 0.85 | CYP1A2 (0.61) | CYP1A2GRM8GRM4ALDH1A1TDP1 | |
| SCHEMBL30959758 | 0.85 | CYP1A2 (0.61) | CYP1A2GRM8GRM4ALDH1A1TDP1 | |
| SCHEMBL1817775 | 0.85 | CYP1A2 (0.61) | CYP1A2GRM8GRM4ALDH1A1TDP1 | |
| SCHEMBL31710991 | 0.82 | CYP1A2 (0.53) | CYP1A2GRM8GRM4PTPRA | |
| SCHEMBL9116030 | 0.82 | GRM8 (0.63) | CYP1A2GRM8GRM4KMO | |
| SCHEMBL21518512 | 0.82 | GRM8 (0.63) | CYP1A2GRM8GRM4KMO | |
| SCHEMBL28064736 | 0.81 | CYP1A2 (0.45) | CYP1A2GRM8GRM4ALDH1A1TDP1 | |
| SCHEMBL3124322 | 0.80 | GRM8 (0.53) | GRM8GRM4 | |
| SCHEMBL4197255 | 0.80 | CYP1A2 (0.71) | CYP1A2ALDH1A1TDP1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-1991005605-A1 | CYCLODEXTRIN LABELS FOR IMMUNOASSAY AND BIOCHEMICAL ANALYSIS | KOSAK KENNETH M (US) | 1991-05-02 | — | — | WO | disclosed |