Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 6/20 | 0.64 |
| ▸ | RAB9A | P51151 | 6/20 | 0.64 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.64 |
| ▸ | MEN1 | O00255 | 5/20 | 0.64 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.64 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.64 |
| ▸ | HPGD | P15428 | 4/20 | 0.64 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.64 |
| ▸ | PKM | P14618 | 3/20 | 0.64 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.64 |
| ▸ | MAPT | P10636 | 7/20 | 0.57 |
| ▸ | LMNA | P02545 | 4/20 | 0.57 |
| ▸ | GAA | P10253 | 3/20 | 0.57 |
| ▸ | GLA | P06280 | 2/20 | 0.57 |
| ▸ | TUBB4A | P04350 | 7/20 | 0.55 |
| ▸ | TUBB | P07437 | 7/20 | 0.55 |
| ▸ | TUBA3C | P0DPH7 | 7/20 | 0.55 |
| ▸ | TUBA1B | P68363 | 7/20 | 0.55 |
| ▸ | TUBA4A | P68366 | 7/20 | 0.55 |
| ▸ | TUBB4B | P68371 | 7/20 | 0.55 |
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 | |
|---|---|---|---|---|
| SCHEMBL28698968 | 1.00 | NPC1 (0.64) | NPC1RAB9AKDM4EMEN1KMT2A | |
| SCHEMBL4623517 | 0.87 | MEN1 (0.72) | NPC1RAB9AKDM4EMEN1KMT2A | |
| SCHEMBL29467917 | 0.81 | NPC1 (0.64) | NPC1RAB9AKDM4EMEN1KMT2A | |
| SCHEMBL6836889 | 0.81 | KDM4E (0.75) | NPC1RAB9AKDM4EMEN1KMT2A | |
| SCHEMBL29467918 | 0.81 | RAB9A (0.64) | NPC1RAB9AKDM4EMEN1KMT2A | |
| SCHEMBL28691230 | 0.81 | RAB9A (0.64) | NPC1RAB9AKDM4EMEN1KMT2A | |
| SCHEMBL28258355 | 0.81 | NPC1 (0.64) | NPC1RAB9AKDM4EMEN1KMT2A | |
| SCHEMBL6836616 | 0.81 | KDM4E (0.75) | NPC1RAB9AKDM4EMEN1KMT2A | |
| SCHEMBL28465009 | 0.80 | NPC1 (0.68) | NPC1RAB9AKDM4EMEN1KMT2A | |
| SCHEMBL537905 | 0.78 | NPC1 (1.00) | NPC1RAB9AKDM4EMEN1KMT2A |
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-108947911-B | Benzimidazole compound with anti-hepatitis B virus activity and antibacterial activity and synthesis method and application thereof | 中山大学 | 2022-02-22 | — | — | CN | disclosed |