Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 1/20 | 0.46 |
| ▸ | CA2 | P00918 | 1/20 | 0.46 |
| ▸ | PTGS1 | P23219 | 6/20 | 0.44 |
| ▸ | PTGS2 | P35354 | 5/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL1929518 | 0.87 | CA1 (0.47) | CA1CA2PTGS1PTGS2 | |
| SCHEMBL1926611 | 0.85 | CA1 (0.46) | CA1CA2PTGS1PTGS2 | |
| SCHEMBL1929209 | 0.84 | CA1 (0.44) | CA1CA2PTGS1PTGS2 | |
| SCHEMBL1930188 | 0.83 | PTGS1 (0.45) | CA1CA2PTGS1PTGS2 | |
| SCHEMBL6960419 | 0.83 | CA1 (0.43) | CA1CA2PTGS1PTGS2 | |
| SCHEMBL6966970 | 0.83 | CA1 (0.43) | CA1CA2PTGS1PTGS2 | |
| Hydrochloric Acid SCHEMBL1926998 | 0.82 | PTGS1 (0.44) | CA1CA2PTGS1PTGS2 | |
| SCHEMBL6959668 | 0.82 | PTGS1 (0.47) | CA1CA2PTGS1PTGS2 | |
| SCHEMBL6959861 | 0.82 | PTGS1 (0.44) | CA1CA2PTGS1PTGS2 | |
| SCHEMBL6952712 | 0.80 | PTGS1 (0.42) | CA1CA2PTGS1PTGS2 |
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 |
|---|---|---|---|---|---|---|---|
| CN-1391474-A | 5-membered heterocyclic derivatives, their preparation and their use as medicaments | SOD CONSEILS RECH APPLIC (FR) | 2003-01-15 | — | — | CN | claimed |
| EP-1223933-A2 | 5-MEMBERED HETEROCYCLE DERIVATIVES, PRODUCTION THEREOF AND USE THEREOF AS MEDICAMENTS | SOCIETE DE CONSEILS DE RECHERCHES ET D'APPLICATIONS SCIENTIFIQUES (S.C.R.A.S.) (FR) | 2002-07-24 | — | — | EP | disclosed |
| WO-2001026656-A2 | 5-MEMBERED HETEROCYCLE DERIVATIVES AND USE THEREOF AS MONOAMINE OXIDASE INHIBITORS | SOCIETE DE CONSEILS DE RECHERCHES ET D'APPLICATIONS SCIENTIFIQUES (S.C.R.A.S.) (FR) | 2001-04-19 | — | — | WO | disclosed |