Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP10 | Q53GL7 | 2/20 | 0.49 |
| ▸ | PARP15 | Q460N3 | 1/20 | 0.49 |
| ▸ | MEN1 | O00255 | 6/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 6/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.44 |
| ▸ | TSHR | P16473 | 2/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.42 |
| ▸ | TAS1R3 | Q7RTX0 | 1/20 | 0.42 |
| ▸ | TAS1R1 | Q7RTX1 | 1/20 | 0.42 |
| ▸ | PKM | P14618 | 3/20 | 0.41 |
| ▸ | RAB9A | P51151 | 2/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | PARP14 | Q460N5 | 1/20 | 0.41 |
| ▸ | CA2 | P00918 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | HTT | P42858 | 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 | |
|---|---|---|---|---|
| SCHEMBL28179901 | 1.00 | PARP10 (0.49) | PARP10PARP15MEN1KMT2AKDM4E | |
| SCHEMBL6714838 | 0.82 | HSD17B10 (0.46) | MEN1KMT2AALDH1A1TAS1R3TAS1R1 | |
| SCHEMBL6714841 | 0.82 | HSD17B10 (0.46) | MEN1KMT2AALDH1A1TAS1R3TAS1R1 | |
| SCHEMBL6718561 | 0.77 | HSD17B10 (0.48) | MEN1KMT2AKDM4EALDH1A1TSHR | |
| SCHEMBL6718559 | 0.77 | HSD17B10 (0.48) | MEN1KMT2AKDM4EALDH1A1TSHR | |
| SCHEMBL30006546 | 0.72 | ALDH1A1 (0.52) | PARP10PARP15MEN1KMT2AKDM4E | |
| SCHEMBL19296181 | 0.72 | PARP10 (0.50) | PARP10PARP15MEN1KMT2AKDM4E | |
| SCHEMBL20597773 | 0.72 | PARP10 (0.50) | PARP10PARP15MEN1KMT2AKDM4E | |
| SCHEMBL6724742 | 0.72 | HSD17B10 (0.56) | MEN1KMT2A | |
| SCHEMBL6724746 | 0.72 | HSD17B10 (0.56) | MEN1KMT2A |
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-109963835-B | Preparation method of neotoxin and intermediate thereof | 江苏恒瑞医药股份有限公司 | 2022-10-21 | — | — | CN | disclosed |