Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LMNA | P02545 | 1/20 | 0.58 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.57 |
| ▸ | CES2 | O00748 | 3/20 | 0.50 |
| ▸ | CES1 | P23141 | 3/20 | 0.50 |
| ▸ | MTNR1A | P48039 | 2/20 | 0.49 |
| ▸ | MTNR1B | P49286 | 2/20 | 0.49 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.46 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.46 |
| ▸ | TBXAS1 | P24557 | 1/20 | 0.44 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | CYP19A1 | P11511 | 4/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL11352148 | 0.98 | TDP1 (0.59) | LMNATDP1CES2CES1MTNR1A | |
| SCHEMBL560984 | 0.95 | LMNA (0.51) | LMNATDP1CES2CES1MTNR1A | |
| SCHEMBL4614904 | 0.87 | MTNR1A (0.53) | LMNATDP1CES2CES1MTNR1A | |
| SCHEMBL4614326 | 0.87 | MTNR1A (0.53) | LMNATDP1CES2CES1MTNR1A | |
| SCHEMBL20534184 | 0.85 | ESR1 (0.57) | LMNATDP1CES2CES1MTNR1A | |
| SCHEMBL20534185 | 0.85 | ESR1 (0.57) | LMNATDP1CES2CES1MTNR1A | |
| SCHEMBL11147118 | 0.83 | CES2 (0.55) | LMNATDP1CES2CES1PTGS2 | |
| SCHEMBL299556 | 0.82 | CES2 (0.50) | LMNATDP1CES2CES1PTGS2 | |
| SCHEMBL9312401 | 0.81 | CES2 (0.56) | LMNATDP1CES2CES1PTGS2 | |
| SCHEMBL11896276 | 0.81 | CES2 (0.56) | LMNATDP1CES2CES1PTGS2 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6706839-B1 | COVALENTLY BONDING SEPARATING AGENT TO REACTANT; ISOMERIZATION | UNIVERSITY OF PITTSBURGH | 2004-03-16 | — | — | US | disclosed |
| EP-1165222-A4 | CHEMICAL PARTITIONING AGENTS AND METHODS OF USING SAME | UNIV PITTSBURGH (US) | 2003-05-21 | — | — | EP | disclosed |
| EP-1165222-A1 | CHEMICAL PARTITIONING AGENTS AND METHODS OF USING SAME | UNIVERSITY OF PITTSBURGH (US) | 2002-01-02 | — | — | EP | disclosed |
| WO-2000047031-A2 | CHEMICAL PARTITIONING AGENTS AND METHODS OF USING SAME | UNIVERSITY OF PITTSBURGH (US) | 2000-08-17 | — | — | WO | disclosed |