Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 3/20 | 0.49 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.49 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.49 |
| ▸ | GAA | P10253 | 2/20 | 0.47 |
| ▸ | RAB9A | P51151 | 3/20 | 0.44 |
| ▸ | MAPT | P10636 | 3/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.44 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.44 |
| ▸ | ATM | Q13315 | 1/20 | 0.43 |
| ▸ | PTPN7 | P35236 | 1/20 | 0.43 |
| ▸ | PTPN12 | Q05209 | 1/20 | 0.43 |
| ▸ | PTPN22 | Q9Y2R2 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 2/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | HPGD | P15428 | 1/20 | 0.42 |
| ▸ | CA2 | P00918 | 1/20 | 0.41 |
| ▸ | F2 | P00734 | 1/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL7044593 | 0.85 | PTGS2 (0.54) | LMNAMCL1MEN1KMT2AALDH1A1 | |
| SCHEMBL7486777 | 0.83 | HPGD (0.56) | GAAMAPTSMN1; SMN2LMNAMCL1 | |
| SCHEMBL9649697 | 0.81 | CA2 (0.42) | MAPTLMNAKMT2AALDH1A1CA2 | |
| SCHEMBL11471018 | 0.81 | KMT2A (0.50) | GAASMN1; SMN2KMT2AALDH1A1HPGD | |
| SCHEMBL7391312 | 0.79 | BCL9 (0.49) | NPC1GAARAB9AMAPTSMN1; SMN2 | |
| SCHEMBL11527161 | 0.78 | GAA (0.55) | NPC1TDP1L3MBTL1GAARAB9A | |
| SCHEMBL11525514 | 0.77 | L3MBTL1 (0.65) | NPC1TDP1L3MBTL1GAARAB9A | |
| SCHEMBL377507 | 0.75 | CYP3A4 (0.52) | TDP1GAAMAPTSMN1; SMN2LMNA | |
| SCHEMBL17242255 | 0.75 | MEN1 (0.53) | MAPTLMNAMEN1KMT2AALDH1A1 | |
| SCHEMBL2221195 | 0.73 | NQO1 (0.50) | TDP1L3MBTL1GAAMAPTLMNA |
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-4163759-A | Process for preparing aromatic hydroxyaldehydes | HAARMANN & REIMER GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 1979-08-07 | — | — | US | disclosed |