Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA2 | P00918 | 12/20 | 0.63 |
| ▸ | CA1 | P00915 | 11/20 | 0.63 |
| ▸ | CA12 | O43570 | 3/20 | 0.56 |
| ▸ | CA9 | Q16790 | 3/20 | 0.56 |
| ▸ | CA4 | P22748 | 3/20 | 0.55 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.50 |
| ▸ | TSHR | P16473 | 1/20 | 0.50 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.50 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.50 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.50 |
| ▸ | MEP1B | Q16820 | 1/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.47 |
| ▸ | GAA | P10253 | 1/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.47 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.47 |
| ▸ | LTA4H | P09960 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL9263159 | 0.85 | ALDH1A1 (0.67) | CA2CA1CA12CA9TDP1 | |
| SCHEMBL9974560 | 0.84 | CA1 (0.64) | CA2CA1CA12CA9CA4 | |
| SCHEMBL9514501 | 0.83 | CA1 (0.68) | CA2CA1CA12CA9CA4 | |
| SCHEMBL15499792 | 0.82 | CA1 (0.75) | CA2CA1CA12CA9CA4 | |
| SCHEMBL1066727 | 0.81 | MAPT (0.59) | CA2CA1CA12CA9ALDH1A1 | |
| SCHEMBL2843886 | 0.80 | CA12 (0.56) | CA2CA1CA12CA9TSHR | |
| SCHEMBL9617679 | 0.79 | BCHE (0.62) | CA2CA1CA12CA9CA4 | |
| SCHEMBL486751 | 0.79 | CA1 (0.58) | CA2CA1CA12CA9CA4 | |
| Iprofenin SCHEMBL486656 | 0.79 | CA1 (0.58) | CA2CA1CA12CA9CA4 | |
| SCHEMBL3911049 | 0.78 | CA12 (0.54) | CA2CA1CA12CA9TSHR |
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-0290041-B1 | Radioactive metal chelates of dipyridoxyl phosphate | NYCOMED SALUTAR INC (US) | 1993-12-08 | — | — | EP | disclosed |
| US-4842845-A | Radioactive metal chelates for dipyridoxyl phosphate | SALUTAR, INC. (US) | 1989-06-27 | — | — | US | disclosed |
| EP-0290041-A2 | Radioactive metal chelates of dipyridoxyl phosphate | NYCOMED SALUTAR, INC. (US) | 1988-11-09 | — | — | EP | disclosed |