Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 2/20 | 0.66 |
| ▸ | MAPT | P10636 | 5/20 | 0.56 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.53 |
| ▸ | RAB9A | P51151 | 4/20 | 0.52 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.52 |
| ▸ | HPGD | P15428 | 1/20 | 0.52 |
| ▸ | HTT | P42858 | 1/20 | 0.51 |
| ▸ | TAS1R3 | Q7RTX0 | 1/20 | 0.51 |
| ▸ | TAS1R1 | Q7RTX1 | 1/20 | 0.51 |
| ▸ | TAS1R2 | Q8TE23 | 1/20 | 0.51 |
| ▸ | BCHE | P06276 | 1/20 | 0.51 |
| ▸ | ASAH1 | Q13510 | 4/20 | 0.50 |
| ▸ | NPC1 | O15118 | 3/20 | 0.49 |
| ▸ | PKM | P14618 | 2/20 | 0.49 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.47 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.47 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.47 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL29195653 | 1.00 | KMT2A (0.66) | KMT2AMAPTSMN1; SMN2RAB9AKDM4E | |
| SCHEMBL29195585 | 0.86 | KMT2A (0.55) | KMT2AMAPTRAB9AKDM4EALDH1A1 | |
| SCHEMBL30846017 | 0.86 | KMT2A (0.55) | KMT2AMAPTRAB9AKDM4EALDH1A1 | |
| SCHEMBL4437431 | 0.84 | ASAH1 (0.62) | KMT2AMAPTSMN1; SMN2RAB9AALDH1A1 | |
| SCHEMBL11690100 | 0.82 | KMT2A (0.63) | KMT2ASMN1; SMN2HTTTAS1R3TAS1R1 | |
| SCHEMBL29195624 | 0.82 | ASAH1 (0.53) | KMT2AMAPTSMN1; SMN2RAB9AALDH1A1 | |
| SCHEMBL30846013 | 0.82 | ASAH1 (0.53) | KMT2AMAPTSMN1; SMN2RAB9AALDH1A1 | |
| SCHEMBL25511522 | 0.81 | KMT2A (0.50) | KMT2AMAPTSMN1; SMN2RAB9AKDM4E | |
| SCHEMBL10355911 | 0.77 | ASAH1 (0.57) | KMT2AMAPTSMN1; SMN2RAB9AKDM4E | |
| SCHEMBL11688725 | 0.76 | ASAH1 (0.50) | KMT2AMAPTRAB9AALDH1A1ASAH1 |
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-117917274-A | Preparation method of novel metal@PCN catalyst and method for preparing 1,2, 4-thiadiazole derivative by using catalyst | 济宁医学院 | 2024-04-23 | — | — | CN | disclosed |