Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.44 |
| ▸ | LMNA | P02545 | 2/20 | 0.39 |
| ▸ | HPGD | P15428 | 3/20 | 0.38 |
| ▸ | MAPT | P10636 | 6/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 3/20 | 0.38 |
| ▸ | RAB9A | P51151 | 3/20 | 0.38 |
| ▸ | HTT | P42858 | 2/20 | 0.38 |
| ▸ | NPC1 | O15118 | 2/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | S1PR4 | O95977 | 1/20 | 0.38 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.37 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.37 |
| ▸ | CRHBP | P24387 | 1/20 | 0.37 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | XBP1 | P17861 | 1/20 | 0.36 |
| ▸ | PAX8 | Q06710 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL3342318 | 0.76 | TSHR (0.51) | ALDH1A1LMNAMAPTNPSR1RAB9A | |
| SCHEMBL8552830 | 0.75 | RAB9A (0.37) | ALDH1A1LMNARAB9AHTTGAA | |
| SCHEMBL10690547 | 0.75 | MAPT (0.51) | ALDH1A1LMNAHPGDMAPTRAB9A | |
| SCHEMBL8554881 | 0.74 | ALDH1A1 (0.35) | ALDH1A1LMNAHPGDMAPTRAB9A | |
| SCHEMBL1286290 | 0.73 | MAPT (0.43) | ALDH1A1LMNAHPGDMAPTNPSR1 | |
| SCHEMBL8566829 | 0.73 | MAPT (0.43) | ALDH1A1LMNAMAPTNPSR1RAB9A | |
| SCHEMBL10683266 | 0.73 | CYP3A4 (0.41) | ALDH1A1LMNAHPGDMAPTNPSR1 | |
| SCHEMBL10689835 | 0.71 | KMT2A (0.43) | ALDH1A1LMNAHPGDMAPTRAB9A | |
| SCHEMBL3146630 | 0.70 | KAT2B (0.50) | ALDH1A1LMNAMAPTMAPK1L3MBTL1 | |
| SCHEMBL1285768 | 0.69 | MAPK1 (0.60) | ALDH1A1LMNAMAPTNPSR1RAB9A |
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 |
|---|---|---|---|---|---|---|---|
| US-5019574-A | 3,4-diaminoquinoline and 3,4-diamino-5,6,7,8-tetrahydroquinoline compounds useful for improving psychoneural function | CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) | 1991-05-28 | — | — | US | disclosed |
| EP-0361489-A2 | Novel 3,4-diaminoquinoline and pyridine compounds | Chugai Seiyaku Kabushiki Kaisha (JP) | 1990-04-04 | — | — | EP | disclosed |