Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 3/20 | 0.52 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.52 |
| ▸ | RAB9A | P51151 | 2/20 | 0.52 |
| ▸ | NPC1 | O15118 | 1/20 | 0.52 |
| ▸ | HTT | P42858 | 1/20 | 0.52 |
| ▸ | MEN1 | O00255 | 4/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.41 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.37 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.37 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 2/20 | 0.36 |
| ▸ | KCNH2 | Q12809 | 3/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.34 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.34 |
| ▸ | HDAC1 | Q13547 | 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 | |
|---|---|---|---|---|
| SCHEMBL28056958 | 0.83 | MGLL (0.41) | MAPTRAB9ANPC1CHRM2CHRM1 | |
| SCHEMBL28056872 | 0.82 | ALDH1A1 (0.42) | MAPTRAB9ANPC1HTTMEN1 | |
| SCHEMBL28056948 | 0.82 | NPC1 (0.40) | RAB9ANPC1L3MBTL1LMNACYP2C9 | |
| SCHEMBL28056866 | 0.80 | SLC6A9 (0.43) | L3MBTL1KCNH2TSHR | |
| SCHEMBL28826651 | 0.79 | ABAT (0.35) | — | |
| SCHEMBL28056874 | 0.76 | PNMT (0.32) | — | |
| SCHEMBL28056953 | 0.74 | KDM4E (0.36) | HTTMEN1KMT2ALMNA | |
| SCHEMBL28056867 | 0.72 | KDM4E (0.36) | MAPTRAB9ANPC1CHRM2CHRM1 | |
| SCHEMBL11765414 | 0.72 | MEN1 (0.39) | MAPTNPSR1RAB9ANPC1HTT | |
| SCHEMBL11766620 | 0.71 | MEN1 (0.38) | MAPTNPSR1RAB9ANPC1HTT |
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-103992265-B | Two three bromo 1,3-bis-pyridine alkali propane and preparation method thereof, using method, recovery method and application | XI'AN JIAOTONG UNIVERSITY (CN) | 2016-02-24 | — | — | CN | disclosed |