Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 6/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.41 |
| ▸ | MAPT | P10636 | 5/20 | 0.41 |
| ▸ | RAB9A | P51151 | 5/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.41 |
| ▸ | HPGD | P15428 | 4/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.41 |
| ▸ | AHR | P35869 | 3/20 | 0.41 |
| ▸ | MEN1 | O00255 | 2/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.41 |
| ▸ | MAOA | P21397 | 3/20 | 0.38 |
| ▸ | GLA | P06280 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | PGAM1 | P18669 | 1/20 | 0.38 |
| ▸ | CASP1 | P29466 | 1/20 | 0.38 |
| ▸ | CASP7 | P55210 | 1/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.38 |
| ▸ | CASP3 | P42574 | 1/20 | 0.36 |
| ▸ | SENP8 | Q96LD8 | 1/20 | 0.36 |
| ▸ | SENP7 | Q9BQF6 | 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 | |
|---|---|---|---|---|
| SCHEMBL11575950 | 0.81 | MAOA (0.60) | NPC1ALDH1A1MAPTRAB9AKDM4E | |
| SCHEMBL29487286 | 0.79 | ALDH1A1 (0.56) | NPC1ALDH1A1MAPTRAB9AKDM4E | |
| SCHEMBL195537 | 0.79 | ALDH1A1 (0.56) | NPC1ALDH1A1MAPTRAB9AKDM4E | |
| SCHEMBL1258329 | 0.75 | MAOB (0.50) | NPC1ALDH1A1MAPTRAB9AKDM4E | |
| SCHEMBL6436055 | 0.75 | MAOA (0.64) | NPC1ALDH1A1MAPTRAB9AKDM4E | |
| SCHEMBL11573807 | 0.75 | TNKS (0.45) | NPC1ALDH1A1MAPTRAB9AKDM4E | |
| SCHEMBL249269 | 0.75 | AHR (0.61) | NPC1ALDH1A1MAPTRAB9AKDM4E | |
| SCHEMBL11634806 | 0.75 | GABRP (0.45) | NPC1ALDH1A1MAPTRAB9AKDM4E | |
| SCHEMBL11123836 | 0.74 | PLA2G2A (0.54) | NPC1ALDH1A1MAPTRAB9AKDM4E | |
| SCHEMBL5031122 | 0.71 | CYP3A4 (0.47) | NPC1ALDH1A1MAPTRAB9AKDM4E |
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-4089961-A | Antipsychotically useful quinolizidylidene derivatives of xanthenes, thioxanthenes and dibenzoxepins | SMITHKLINE CORPORATION (US) | 1978-05-16 | — | — | US | disclosed |