Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 2/20 | 0.54 |
| ▸ | APP | P05067 | 2/20 | 0.48 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.44 |
| ▸ | MEN1 | O00255 | 1/20 | 0.44 |
| ▸ | NPC1 | O15118 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.44 |
| ▸ | HPGD | P15428 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.44 |
| ▸ | FFAR1 | O14842 | 3/20 | 0.40 |
| ▸ | FFAR4 | Q5NUL3 | 3/20 | 0.40 |
| ▸ | ASIC3 | Q9UHC3 | 3/20 | 0.40 |
| ▸ | CA12 | O43570 | 2/20 | 0.38 |
| ▸ | CA1 | P00915 | 2/20 | 0.38 |
| ▸ | CA2 | P00918 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL5134940 | 0.79 | APP (0.57) | MAPTAPPCYP1A2CYP3A4CYP2C9 | |
| SCHEMBL18561138 | 0.76 | MAPT (0.65) | MAPTAPPCYP1A2CYP3A4CYP2C9 | |
| SCHEMBL13717014 | 0.76 | MAPT (0.73) | MAPTAPPCYP1A2CYP3A4CYP2C9 | |
| SCHEMBL17617299 | 0.76 | FFAR1 (0.44) | MAPTAPPFFAR1FFAR4ASIC3 | |
| SCHEMBL16598714 | 0.75 | APP (0.52) | MAPTAPPCYP1A2CYP3A4CYP2C9 | |
| SCHEMBL27919460 | 0.75 | APP (0.52) | MAPTAPPCYP1A2CYP3A4CYP2C9 | |
| SCHEMBL18561133 | 0.74 | MAPT (0.70) | MAPTAPPCYP1A2CYP3A4CYP2C9 | |
| SCHEMBL20593905 | 0.73 | GRM5 (0.52) | MAPTAPPCYP1A2CYP3A4CYP2C9 | |
| SCHEMBL17104750 | 0.73 | APP (0.58) | MAPTAPPCYP1A2CYP3A4CYP2C9 | |
| SCHEMBL10300049 | 0.73 | APP (0.63) | MAPTAPPCYP1A2CYP3A4CYP2C9 |
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 |
|---|---|---|---|---|---|---|---|
| EP-3497091-B1 | CONDENSED THIOPHENE DERIVATIVES USEFUL AS NAPI-IIB INHIBITORS | LILLY CO ELI (US) | 2020-10-07 | — | — | EP | disclosed |