Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | APP | P05067 | 1/20 | 0.51 |
| ▸ | CAPN1 | P07384 | 1/20 | 0.49 |
| ▸ | MIF | P14174 | 6/20 | 0.49 |
| ▸ | AMY1A | P0DUB6 | 1/20 | 0.47 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.46 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.46 |
| ▸ | CA2 | P00918 | 3/20 | 0.45 |
| ▸ | CA9 | Q16790 | 3/20 | 0.45 |
| ▸ | CA5A | P35218 | 1/20 | 0.45 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.44 |
| ▸ | CA12 | O43570 | 2/20 | 0.43 |
| ▸ | CA1 | P00915 | 2/20 | 0.43 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL5924300 | 0.87 | APP (0.48) | APPCAPN1MIFAMY1APTGS2 | |
| SCHEMBL6920619 | 0.85 | APP (0.51) | APPCAPN1MIFAMY1APTGS2 | |
| SCHEMBL17978570 | 0.80 | PTGS2 (0.50) | MIFAMY1APTGS2CYP19A1CA2 | |
| SCHEMBL5924217 | 0.80 | CA12 (0.61) | PTGS2CA2CA9NOTUMCA12 | |
| SCHEMBL5924379 | 0.77 | CA2 (0.62) | AMY1APTGS2CYP19A1CA2CA9 | |
| SCHEMBL29124528 | 0.77 | PTGS2 (0.52) | AMY1APTGS2CYP19A1CA2CA9 | |
| SCHEMBL17978576 | 0.77 | PTGS2 (0.52) | AMY1APTGS2CYP19A1CA2CA9 | |
| SCHEMBL17978617 | 0.77 | MIF (0.49) | APPCAPN1MIFAMY1APTGS2 | |
| SCHEMBL17978619 | 0.76 | DRD2 (0.54) | APPCAPN1MIFPTGS2CYP19A1 | |
| SCHEMBL6920626 | 0.76 | CA9 (0.48) | APPCAPN1AMY1APTGS2CYP19A1 |
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-2004101531-A1 | ANTIINFECTIVE 1,2,3-TRIAZOLE DERIVATIVES, PROCESS FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM | DR. REDDY'S LABORATORIES LTD. (IN) | 2004-11-25 | — | — | WO | disclosed |