Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TNF | P01375 | 12/20 | 0.52 |
| ▸ | CNR1 | P21554 | 2/20 | 0.42 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.38 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.38 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.38 |
| ▸ | KCNH2 | Q12809 | 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 | |
|---|---|---|---|---|
| SCHEMBL8850540 | 0.88 | TNF (0.52) | TNFCNR1GAACYP2D6 | |
| SCHEMBL8850960 | 0.86 | TNF (0.47) | TNFGAA | |
| SCHEMBL8850682 | 0.86 | CYP1A2 (0.40) | TNFSLC6A2SLC6A4SLC6A3KCNH2 | |
| SCHEMBL8851024 | 0.84 | TNF (0.46) | TNFGAA | |
| SCHEMBL6199826 | 0.80 | UGT2B7 (0.37) | TNFCYP2D6SLC6A2SLC6A4SLC6A3 | |
| SCHEMBL27463723 | 0.80 | TNF (0.45) | TNFCNR1GAACYP2D6SLC6A2 | |
| SCHEMBL8850165 | 0.78 | TNF (0.53) | TNFCNR1GAACYP2D6 | |
| SCHEMBL8850434 | 0.77 | ALDH1A1 (0.36) | TNFGAACYP2D6SLC6A2SLC6A4 | |
| SCHEMBL8850201 | 0.73 | FABP4 (0.40) | CYP2D6 | |
| SCHEMBL8851069 | 0.73 | KDM4E (0.36) | TNFGAACYP2D6 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5688815-A | COMPOUNDS FOR REMOVAL OF EXCESS IRON IN MAMMALS | CIBA GEIGY CORPORATION (US) | 1997-11-18 | — | — | US | disclosed |
| CN-1151399-A | Novel hydroxylpyridinones | CIBA GEIGY AG (CH) | 1997-06-11 | — | — | CN | disclosed |