Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DAO | P14920 | 1/20 | 0.43 |
| ▸ | MRGPRX4 | Q96LA9 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 2/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 6/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.40 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 2/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | MAOB | P27338 | 2/20 | 0.36 |
| ▸ | MAOA | P21397 | 1/20 | 0.36 |
| ▸ | PLAT | P00750 | 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 | |
|---|---|---|---|---|
| SCHEMBL6829308 | 0.80 | MRGPRX4 (0.47) | MRGPRX4NPC1RAB9A | |
| SCHEMBL6920177 | 0.79 | NPC1 (0.40) | NPC1RAB9ATDP1MAOBMAOA | |
| SCHEMBL7126366 | 0.77 | L3MBTL1 (0.43) | DAOMAPTNPC1RAB9AALDH1A1 | |
| SCHEMBL6828965 | 0.77 | MAOB (0.40) | MRGPRX4NPC1RAB9AKDM4EALDH1A1 | |
| SCHEMBL6828913 | 0.75 | MAOB (0.49) | MRGPRX4MAPTNPC1RAB9AALDH1A1 | |
| SCHEMBL7131180 | 0.75 | MAOB (0.51) | NPC1RAB9AALDH1A1POLBTDP1 | |
| SCHEMBL7622395 | 0.74 | HTT (0.34) | MRGPRX4 | |
| SCHEMBL6829285 | 0.73 | MAOB (0.44) | MRGPRX4MAPTRAB9AALDH1A1HRH3 | |
| SCHEMBL6828653 | 0.72 | MRGPRX4 (0.64) | DAOMRGPRX4KDM4EALDH1A1HRH3 | |
| SCHEMBL9128904 | 0.71 | RAB9A (0.55) | MRGPRX4NPC1RAB9AALDH1A1HRH3 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2004037808-A1 | 2 - SUBSTITUTED HETEROCYCLIC COMPOUNDS AND ANTITUMOR COMPOSITION COMPRISING THE SAME | CHONG KUN DANG PHARMACEUTICAL CORP. (KR) | 2004-05-06 | — | — | WO | disclosed |