Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOA | P21397 | 1/20 | 0.42 |
| ▸ | MAOB | P27338 | 1/20 | 0.42 |
| ▸ | METAP1 | P53582 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.39 |
| ▸ | PDE4A | P27815 | 1/20 | 0.39 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.39 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.39 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.39 |
| ▸ | NPY5R | Q15761 | 3/20 | 0.39 |
| ▸ | MEN1 | O00255 | 4/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.38 |
| ▸ | MAPT | P10636 | 3/20 | 0.38 |
| ▸ | NPC1 | O15118 | 2/20 | 0.38 |
| ▸ | RAB9A | P51151 | 2/20 | 0.38 |
| ▸ | TAAR1 | Q96RJ0 | 2/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.38 |
| ▸ | TLR8 | Q9NR97 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL27962998 | 0.79 | ALDH1A1 (0.50) | ALDH1A1MEN1KMT2AMAPTNPC1 | |
| SCHEMBL5505630 | 0.78 | TYMS (0.39) | KMT2AMAPTGAA | |
| SCHEMBL12496376 | 0.77 | ALDH1A1 (0.41) | ALDH1A1MEN1KMT2AKDM4EMAPT | |
| SCHEMBL3337224 | 0.77 | NUDT1 (0.61) | MAOAMAOBMETAP1PDE4APDE4B | |
| SCHEMBL1980544 | 0.75 | IGF1R (0.52) | MAOAMAOBALDH1A1MEN1KMT2A | |
| SCHEMBL12495765 | 0.73 | ADH1B (0.38) | ALDH1A1MEN1KMT2AKDM4EMAPT | |
| SCHEMBL28212751 | 0.73 | ADORA3 (0.61) | ALDH1A1MEN1KMT2AKDM4EMAPT | |
| SCHEMBL27845963 | 0.73 | MAOA (0.47) | MAOAMAOBMETAP1ALDH1A1PDE4A | |
| SCHEMBL24287271 | 0.72 | KDM4E (0.59) | ALDH1A1MEN1KMT2AKDM4EMAPT | |
| SCHEMBL29516515 | 0.72 | KDM4E (0.59) | ALDH1A1MEN1KMT2AKDM4EMAPT |
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 |
|---|---|---|---|---|---|---|---|
| CN-106008373-B | Disubstituted bicyclic derivative and its application as efflux pump inhibitor in antibacterial | 山东大学 | 2019-02-22 | — | — | CN | disclosed |