Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 5/20 | 0.47 |
| ▸ | RAB9A | P51151 | 4/20 | 0.47 |
| ▸ | LMNA | P02545 | 2/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.47 |
| ▸ | POLB | P06746 | 1/20 | 0.47 |
| ▸ | MLYCD | O95822 | 2/20 | 0.46 |
| ▸ | GAA | P10253 | 1/20 | 0.45 |
| ▸ | MEN1 | O00255 | 2/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.45 |
| ▸ | F10 | P00742 | 1/20 | 0.45 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.45 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.45 |
| ▸ | MAPT | P10636 | 4/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.44 |
| ▸ | HPGD | P15428 | 1/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.44 |
| ▸ | HTT | P42858 | 2/20 | 0.44 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL28259969 | 0.86 | MEN1 (0.57) | NPC1RAB9ALMNAKDM4EMEN1 | |
| SCHEMBL27972580 | 0.84 | BCHE (0.49) | NPC1RAB9AKDM4EGAAMEN1 | |
| SCHEMBL27972631 | 0.82 | MAPT (0.51) | NPC1RAB9ALMNAGAAMEN1 | |
| SCHEMBL28866664 | 0.80 | PTPN1 (0.52) | NPC1RAB9AKDM4EPOLBGAA | |
| SCHEMBL28894329 | 0.79 | PPARA (0.41) | POLBGAAMEN1KMT2AMAPT | |
| SCHEMBL27972283 | 0.79 | MEN1 (0.41) | NPC1RAB9ALMNAKDM4EMEN1 | |
| SCHEMBL27972587 | 0.78 | ALDH1A1 (0.53) | NPC1RAB9ALMNAKDM4EPOLB | |
| SCHEMBL27972318 | 0.78 | PTPN1 (0.48) | NPC1LMNAPOLBMEN1KMT2A | |
| SCHEMBL27972313 | 0.78 | KCNJ5 (0.50) | LMNAKDM4EPOLBMEN1KMT2A | |
| SCHEMBL28423745 | 0.78 | LMNA (0.50) | LMNAKDM4EGAAMEN1KMT2A |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-110483423-A | P2X4 receptor antagonist | NIPPON CHEMIPHAR CO | 2019-11-22 | — | — | CN | disclosed |
| CN-108863959-A | P2X4 RECEPTOR ANTAGONIST | 日本化学药品株式会社 | 2018-11-23 | — | — | CN | disclosed |