Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNK3 | O14649 | 2/20 | 0.62 |
| ▸ | KCNK9 | Q9NPC2 | 2/20 | 0.62 |
| ▸ | NPC1 | O15118 | 8/20 | 0.61 |
| ▸ | RAB9A | P51151 | 8/20 | 0.61 |
| ▸ | SMN1; SMN2 | Q16637 | 6/20 | 0.61 |
| ▸ | PKM | P14618 | 2/20 | 0.61 |
| ▸ | HTT | P42858 | 2/20 | 0.61 |
| ▸ | TSHR | P16473 | 2/20 | 0.60 |
| ▸ | MEN1 | O00255 | 7/20 | 0.59 |
| ▸ | KMT2A | Q03164 | 7/20 | 0.59 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.59 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.58 |
| ▸ | TP53 | P04637 | 4/20 | 0.58 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.58 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.58 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.58 |
| ▸ | RELA | Q04206 | 1/20 | 0.58 |
| ▸ | POLB | P06746 | 1/20 | 0.58 |
| ▸ | NLRP3 | Q96P20 | 1/20 | 0.57 |
| ▸ | HPGD | P15428 | 1/20 | 0.57 |
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 | |
|---|---|---|---|---|
| SCHEMBL29249362 | 0.87 | NPC1 (0.58) | KCNK3KCNK9NPC1RAB9ASMN1; SMN2 | |
| SCHEMBL29249357 | 0.84 | KCNK3 (0.54) | KCNK3KCNK9NPC1RAB9ASMN1; SMN2 | |
| SCHEMBL30862297 | 0.78 | RXFP1 (0.94) | KCNK3KCNK9NPC1RAB9ASMN1; SMN2 | |
| SCHEMBL4251968 | 0.78 | RXFP1 (0.94) | KCNK3KCNK9NPC1RAB9ASMN1; SMN2 | |
| SCHEMBL29249359 | 0.78 | KCNK3 (0.60) | KCNK3KCNK9NPC1RAB9ASMN1; SMN2 | |
| SCHEMBL5226157 | 0.77 | NPC1 (1.00) | KCNK3KCNK9NPC1RAB9ASMN1; SMN2 | |
| SCHEMBL6802217 | 0.77 | NPC1 (0.83) | KCNK3KCNK9NPC1RAB9ASMN1; SMN2 | |
| SCHEMBL29249356 | 0.77 | NR1H4 (0.56) | SMN1; SMN2MEN1KMT2AKDM4EPOLB | |
| SCHEMBL23070447 | 0.76 | RAB9A (0.81) | KCNK3KCNK9NPC1RAB9ASMN1; SMN2 | |
| SCHEMBL7824945 | 0.76 | KMT2A (0.82) | KCNK3KCNK9NPC1RAB9ASMN1; SMN2 |
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-118324653-A | Compound, metal compound, preparation method and application thereof, contrast agent and imaging method | 四川大学 | 2024-07-12 | — | — | CN | disclosed |