Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.37 |
| ▸ | TP53 | P04637 | 4/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 2/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | HTT | P42858 | 1/20 | 0.32 |
| ▸ | ERN1 | O75460 | 1/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
| ▸ | HPGD | P15428 | 1/20 | 0.31 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.31 |
| ▸ | ERCC5 | P28715 | 1/20 | 0.30 |
| ▸ | FEN1 | P39748 | 1/20 | 0.30 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.30 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL28247019 | 0.86 | LMNA (0.43) | TDP1TP53MEN1KMT2ATSHR | |
| SCHEMBL27643666 | 0.86 | PSEN1 (0.33) | ALDH1A1LMNAHTTCYP1A2CYP2C19 | |
| SCHEMBL28758196 | 0.84 | PSEN1 (0.33) | TDP1ERN1 | |
| SCHEMBL27601029 | 0.83 | ERN1 (0.44) | TDP1TP53ALDH1A1MAPTMEN1 | |
| SCHEMBL27624261 | 0.83 | CYP3A4 (0.36) | TDP1TP53ALDH1A1MAPTPOLB | |
| SCHEMBL27600247 | 0.79 | MDM2 (0.37) | ALDH1A1MAPTMEN1KMT2ACYP3A4 | |
| SCHEMBL27624244 | 0.79 | PDE2A (0.40) | ALDH1A1MEN1KMT2ATSHRCYP3A4 | |
| SCHEMBL27559386 | 0.78 | NISCH (0.37) | TDP1ALDH1A1MAPTMEN1KMT2A | |
| SCHEMBL28032086 | 0.77 | ALDH1A1 (0.36) | TDP1ALDH1A1MAPTTSHRMAPK1 | |
| SCHEMBL2311541 | 0.76 | TDP1 (0.41) | TDP1TP53ALDH1A1MAPTMEN1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-101675045-B | Hetarylanilines as modulators for amyloid beta | HOFFMANN LA ROCHE | 2012-11-28 | — | — | CN | disclosed |
| CN-101675045-A | Hetarylanilines as modulators for amyloid beta | HOFFMANN LA ROCHE | 2010-03-17 | — | — | CN | disclosed |