Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | GSK3B | P49841 | 1/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.38 |
| ▸ | MTNR1B | P49286 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | PLA2G1B | P04054 | 1/20 | 0.38 |
| ▸ | ATG4B | Q9Y4P1 | 1/20 | 0.38 |
| ▸ | CNR1 | P21554 | 1/20 | 0.37 |
| ▸ | CNR2 | P34972 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL9683539 | 0.84 | GLS (0.41) | ALDH1A1L3MBTL1NPC1RAB9ASMN1; SMN2 | |
| SCHEMBL9683532 | 0.84 | GLS (0.41) | ALDH1A1L3MBTL1NPC1RAB9ASMN1; SMN2 | |
| SCHEMBL10680751 | 0.83 | CES2 (0.47) | ALDH1A1KMT2ASMN1; SMN2CYP1A2 | |
| SCHEMBL6787347 | 0.80 | ALOX15 (0.49) | ALDH1A1KMT2AL3MBTL1GSK3BNPC1 | |
| SCHEMBL9683501 | 0.78 | MTNR1A (0.38) | ALDH1A1L3MBTL1NPC1RAB9ASMN1; SMN2 | |
| SCHEMBL378101 | 0.77 | KMT2A (0.49) | ALDH1A1KMT2ANPC1RAB9ASMN1; SMN2 | |
| SCHEMBL1394924 | 0.75 | PTGS2 (0.63) | L3MBTL1CYP1A2 | |
| SCHEMBL1394923 | 0.75 | PTGS2 (0.63) | L3MBTL1CYP1A2 | |
| SCHEMBL9681759 | 0.75 | TDP1 (0.41) | ALDH1A1KMT2AL3MBTL1NPC1RAB9A | |
| SCHEMBL8933321 | 0.72 | ALDH1A1 (0.47) | ALDH1A1KMT2AL3MBTL1GSK3BRAB9A |
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-5087631-A | Vasodilators for treating cardiovascular disorders | GLAXO INC. (US) | 1992-02-11 | — | — | US | disclosed |