Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.39 |
| ▸ | MEN1 | O00255 | 2/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.38 |
| ▸ | LMNA | P02545 | 2/20 | 0.38 |
| ▸ | CA1 | P00915 | 2/20 | 0.37 |
| ▸ | CA2 | P00918 | 2/20 | 0.37 |
| ▸ | CA7 | P43166 | 2/20 | 0.37 |
| ▸ | CA4 | P22748 | 1/20 | 0.37 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.36 |
| ▸ | CA12 | O43570 | 1/20 | 0.34 |
| ▸ | CA9 | Q16790 | 1/20 | 0.34 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL7984000 | 1.00 | SMN1; SMN2 (0.42) | SMN1; SMN2KMT2AMEN1L3MBTL1NPC1 | |
| SCHEMBL15026426 | 0.89 | CA1 (0.46) | SMN1; SMN2KMT2AMEN1ALDH1A1LMNA | |
| SCHEMBL7281037 | 0.87 | KMT2A (0.39) | SMN1; SMN2KMT2AMEN1L3MBTL1NPC1 | |
| SCHEMBL7281040 | 0.87 | KMT2A (0.39) | SMN1; SMN2KMT2AMEN1L3MBTL1NPC1 | |
| SCHEMBL4539662 | 0.84 | MAPT (0.46) | SMN1; SMN2KMT2AMEN1L3MBTL1NPC1 | |
| SCHEMBL4539659 | 0.84 | MAPT (0.46) | SMN1; SMN2KMT2AMEN1L3MBTL1NPC1 | |
| SCHEMBL10387257 | 0.84 | MAPT (0.46) | SMN1; SMN2KMT2AMEN1L3MBTL1NPC1 | |
| SCHEMBL7322381 | 0.84 | SMN1; SMN2 (0.38) | SMN1; SMN2KMT2AMEN1L3MBTL1NPC1 | |
| SCHEMBL7322373 | 0.84 | SMN1; SMN2 (0.38) | SMN1; SMN2KMT2AMEN1L3MBTL1NPC1 | |
| SCHEMBL822823 | 0.83 | KMT2A (0.47) | SMN1; SMN2KMT2AMEN1L3MBTL1NPC1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6194428-B1 | BRAIN DISORDERS; PSYCHOLOGICAL DISORDERS | BAYER AKTIENGESELLSCHAFT (DE) | 2001-02-27 | — | — | US | disclosed |
| US-6121284-A | SPECIFIED 1-(ALKYL OR CYCLOALKYL)-2-METHYL-3-(ALKOXYCARBONYL)-4-(SUBSTITUTED PYRIDYL OR ARYL)-5-OXO-1,4,5,6,7,8-HEXAHYDROQUINOLINE COMPOUNDS; TREATING SICKLE CELL ANEMIA, PSYCHOSES, DEPRESSION | BAYER AKTIENGESELLSCHAFT (DE) | 2000-09-19 | — | — | US | disclosed |
| US-4742069-A | CALCIUM ANTAGONIST, ANTIANGINA, ANTIISCHEMIC, HYPOTENSIVE | HOFFMANN-LA ROCHE INC. (US) | 1988-05-03 | — | — | US | disclosed |