Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.40 |
| ▸ | ACLY | P53396 | 2/20 | 0.39 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.38 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 3/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.38 |
| ▸ | HPGD | P15428 | 3/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.38 |
| ▸ | TP53 | P04637 | 2/20 | 0.37 |
| ▸ | MAPT | P10636 | 2/20 | 0.37 |
| ▸ | GAA | P10253 | 2/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
| ▸ | AVPR2 | P30518 | 1/20 | 0.36 |
| ▸ | GPR27 | Q9NS67 | 1/20 | 0.36 |
| ▸ | KAT6A | Q92794 | 1/20 | 0.36 |
| ▸ | KAT5 | Q92993 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL8519559 | 0.90 | ABCB11 (0.38) | SMN1; SMN2ABCB11PTGS2ALDH1A1HPGD | |
| SCHEMBL8518393 | 0.89 | PTGS2 (0.47) | SMN1; SMN2NPC1RAB9AABCB11PTGS2 | |
| SCHEMBL8518402 | 0.85 | ABCB11 (0.47) | SMN1; SMN2ABCB11PTGS2ALDH1A1HPGD | |
| SCHEMBL8518493 | 0.83 | ABCB11 (0.60) | SMN1; SMN2NPC1ABCB11PTGS2MEN1 | |
| SCHEMBL8519370 | 0.83 | ABCB11 (0.46) | SMN1; SMN2ABCB11PTGS2KMT2AALDH1A1 | |
| SCHEMBL8518661 | 0.82 | POLB (0.38) | SMN1; SMN2NPC1RAB9AMEN1KMT2A | |
| SCHEMBL8519156 | 0.81 | OPRK1 (0.46) | SMN1; SMN2NPC1RAB9AABCB11PTGS2 | |
| SCHEMBL8519798 | 0.81 | ABCB11 (0.43) | SMN1; SMN2HSD11B1ACLYABCB11PTGS2 | |
| SCHEMBL8520241 | 0.80 | KMT2A (0.38) | SMN1; SMN2NPC1RAB9AABCB11PTGS2 | |
| Hydrochloric Acid SCHEMBL8518624 | 0.76 | VNN1 (0.43) | ABCB11PTGS2HPGDCYP3A4CYP2C19 |
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 |