Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES2 | O00748 | 3/20 | 0.51 |
| ▸ | CES1 | P23141 | 3/20 | 0.51 |
| ▸ | PTGS2 | P35354 | 3/20 | 0.46 |
| ▸ | LMNA | P02545 | 1/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.42 |
| ▸ | TBXAS1 | P24557 | 1/20 | 0.42 |
| ▸ | NAAA | Q02083 | 1/20 | 0.41 |
| ▸ | ESR1 | P03372 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL4822579 | 0.94 | PTGS2 (0.52) | CES2CES1PTGS2LMNANAAA | |
| SCHEMBL11147118 | 0.85 | CES2 (0.55) | CES2CES1PTGS2LMNATDP1 | |
| SCHEMBL27526812 | 0.83 | CES2 (0.56) | CES2CES1PTGS2LMNATDP1 | |
| SCHEMBL11896276 | 0.83 | CES2 (0.56) | CES2CES1PTGS2LMNATDP1 | |
| SCHEMBL9312401 | 0.83 | CES2 (0.56) | CES2CES1PTGS2LMNATDP1 | |
| SCHEMBL27608811 | 0.83 | CES2 (0.56) | CES2CES1PTGS2LMNATDP1 | |
| SCHEMBL7052945 | 0.80 | LMNA (0.58) | CES2CES1PTGS2LMNATDP1 | |
| SCHEMBL299556 | 0.80 | CES2 (0.50) | CES2CES1PTGS2LMNATDP1 | |
| SCHEMBL4822366 | 0.79 | LMNA (0.35) | PTGS2LMNA | |
| SCHEMBL16728092 | 0.79 | CES2 (0.57) | CES2CES1LMNATBXAS1NAAA |
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 |
|---|---|---|---|---|---|---|---|
| WO-2009131692-A1 | SUBSTRATES FOR DELIVERY OF PHYSIOLOGICALLY ACTIVE AGENTS | THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ALABAMA (US) | 2009-10-29 | — | — | WO | claimed |
| WO-2009131692-A1 | SUBSTRATES FOR DELIVERY OF PHYSIOLOGICALLY ACTIVE AGENTS | THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ALABAMA (US) | 2009-10-29 | — | — | WO | disclosed |