Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 9/20 | 0.58 |
| ▸ | RAB9A | P51151 | 9/20 | 0.58 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.58 |
| ▸ | TDP1 | Q9NUW8 | 4/20 | 0.58 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.58 |
| ▸ | HKDC1 | Q2TB90 | 1/20 | 0.58 |
| ▸ | MEN1 | O00255 | 7/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 7/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.46 |
| ▸ | HPGD | P15428 | 1/20 | 0.46 |
| ▸ | GFER | P55789 | 1/20 | 0.43 |
| ▸ | PKM | P14618 | 2/20 | 0.42 |
| ▸ | NTRK1 | P04629 | 1/20 | 0.41 |
| ▸ | NTRK2 | Q16620 | 1/20 | 0.41 |
| ▸ | TAS1R3 | Q7RTX0 | 1/20 | 0.41 |
| ▸ | TAS1R1 | Q7RTX1 | 1/20 | 0.41 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL30675320 | 0.89 | NPC1 (0.53) | NPC1RAB9AKDM4ETDP1L3MBTL1 | |
| SCHEMBL2098094 | 0.89 | NPC1 (0.53) | NPC1RAB9AKDM4ETDP1L3MBTL1 | |
| SCHEMBL6979439 | 0.87 | NPC1 (0.46) | NPC1RAB9AKDM4ETDP1L3MBTL1 | |
| SCHEMBL16736489 | 0.85 | NPC1 (0.53) | NPC1RAB9AKDM4ETDP1L3MBTL1 | |
| SCHEMBL3750026 | 0.83 | KMT2A (0.60) | NPC1RAB9AKDM4ETDP1L3MBTL1 | |
| SCHEMBL31078939 | 0.81 | RAB9A (0.49) | NPC1RAB9AKDM4ETDP1L3MBTL1 | |
| SCHEMBL7780171 | 0.81 | KDM4E (0.55) | NPC1RAB9AKDM4ETDP1L3MBTL1 | |
| SCHEMBL27493245 | 0.79 | CA2 (0.56) | NPC1RAB9AKDM4ETDP1L3MBTL1 | |
| SCHEMBL31079238 | 0.77 | NTRK1 (0.45) | NPC1RAB9AKDM4ETDP1L3MBTL1 | |
| SCHEMBL15326460 | 0.76 | NPC1 (0.47) | NPC1RAB9AKDM4ETDP1L3MBTL1 |
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-115109011-B | Benzothiazole compound, preparation method and application | 河北师范大学 | 2023-12-15 | — | — | CN | disclosed |