Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.48 |
| ▸ | LMNA | P02545 | 2/20 | 0.48 |
| ▸ | ENPP3 | O14638 | 1/20 | 0.46 |
| ▸ | ALPL | P05186 | 1/20 | 0.46 |
| ▸ | XIAP | P98170 | 1/20 | 0.46 |
| ▸ | SRD5A2 | P31213 | 2/20 | 0.43 |
| ▸ | CES2 | O00748 | 2/20 | 0.42 |
| ▸ | CES1 | P23141 | 2/20 | 0.42 |
| ▸ | PTGS2 | P35354 | 3/20 | 0.41 |
| ▸ | CXCL8 | P10145 | 1/20 | 0.41 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.41 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.41 |
| ▸ | GLO1 | Q04760 | 1/20 | 0.41 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.40 |
| ▸ | CNR1 | P21554 | 1/20 | 0.40 |
| ▸ | CNR2 | P34972 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 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 | |
|---|---|---|---|---|
| SCHEMBL8401815 | 0.83 | SRD5A2 (0.45) | SRD5A2CES2CES1PTGS2ABCB11 | |
| SCHEMBL8404826 | 0.81 | FLT1 (0.38) | ALDH1A1ENPP3ALPLXIAPPTGS2 | |
| SCHEMBL11016599 | 0.79 | SRD5A2 (0.50) | ALDH1A1LMNASRD5A2CES2CES1 | |
| SCHEMBL8399669 | 0.74 | ABCB11 (0.48) | ALDH1A1LMNAENPP3ALPLXIAP | |
| SCHEMBL11037236 | 0.73 | ABCB11 (0.50) | ALDH1A1LMNASRD5A2PTGS2ABCB11 | |
| SCHEMBL5219305 | 0.72 | ABCB11 (0.46) | ALDH1A1LMNASRD5A2CES2CES1 | |
| SCHEMBL8402112 | 0.72 | MAPT (0.47) | ALDH1A1LMNASRD5A2CES2CES1 | |
| SCHEMBL11000934 | 0.70 | ALDH1A1 (0.38) | ALDH1A1LMNAENPP3ALPLXIAP | |
| SCHEMBL8403364 | 0.70 | ALDH1A1 (0.48) | ALDH1A1LMNAENPP3ALPLXIAP | |
| SCHEMBL822185 | 0.69 | ALDH1A1 (1.00) | ALDH1A1LMNASRD5A2CES2CES1 |
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 |
|---|---|---|---|---|---|---|---|
| US-5952368-A | AN INHIBITORS OF PROSTAGLANDIN G/H SYNTHASE, ANTIINFLAMMATORY AND ANALGESIC AGENTS | SYNTEX (U.S.A.) INC. (US) | 1999-09-14 | — | — | US | disclosed |