Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.82 |
| ▸ | POLB | P06746 | 1/20 | 0.82 |
| ▸ | SMN1; SMN2 | Q16637 | 8/20 | 0.69 |
| ▸ | MAPT | P10636 | 4/20 | 0.69 |
| ▸ | HTT | P42858 | 3/20 | 0.69 |
| ▸ | NPC1 | O15118 | 3/20 | 0.69 |
| ▸ | RAB9A | P51151 | 2/20 | 0.69 |
| ▸ | MEN1 | O00255 | 5/20 | 0.66 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.66 |
| ▸ | LMNA | P02545 | 2/20 | 0.66 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.66 |
| ▸ | HPGD | P15428 | 4/20 | 0.62 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.57 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.56 |
| ▸ | ATM | Q13315 | 1/20 | 0.56 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.56 |
| ▸ | TSHR | P16473 | 1/20 | 0.55 |
| ▸ | NPY2R | P49146 | 1/20 | 0.55 |
| ▸ | TP53 | P04637 | 1/20 | 0.54 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.54 |
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 | |
|---|---|---|---|---|
| SCHEMBL12994617 | 0.86 | ALDH1A1 (0.82) | ALDH1A1POLBSMN1; SMN2MAPTHTT | |
| SCHEMBL14740658 | 0.85 | ALDH1A1 (0.60) | ALDH1A1POLBSMN1; SMN2MAPTHTT | |
| SCHEMBL10053020 | 0.84 | MAPT (0.60) | ALDH1A1POLBSMN1; SMN2MAPTHTT | |
| SCHEMBL8235480 | 0.84 | ALDH1A1 (0.79) | ALDH1A1POLBSMN1; SMN2MAPTHTT | |
| SCHEMBL14740643 | 0.83 | ALDH1A1 (0.56) | ALDH1A1POLBSMN1; SMN2MAPTHTT | |
| SCHEMBL27883729 | 0.83 | ALDH1A1 (0.60) | ALDH1A1POLBSMN1; SMN2MAPTHTT | |
| SCHEMBL22031718 | 0.82 | ALDH1A1 (0.82) | ALDH1A1POLBSMN1; SMN2MAPTHTT | |
| SCHEMBL20897565 | 0.82 | ALDH1A1 (0.82) | ALDH1A1POLBSMN1; SMN2MAPTHTT | |
| SCHEMBL27517703 | 0.82 | ALDH1A1 (0.82) | ALDH1A1POLBSMN1; SMN2MAPTHTT | |
| SCHEMBL19066237 | 0.82 | ALDH1A1 (0.82) | ALDH1A1POLBSMN1; SMN2MAPTHTT |
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 |
|---|---|---|---|---|---|---|---|
| CN-101321529-A | Diaryl aether derivant as antineoplastic agent | OTSUKA PHARMA CO LTD (JP) | 2008-12-10 | — | — | CN | disclosed |