Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | P2RX7 | Q99572 | 1/20 | 0.51 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.47 |
| ▸ | KDM6B | O15054 | 1/20 | 0.47 |
| ▸ | KDM4A | O75164 | 1/20 | 0.47 |
| ▸ | KDM5C | P41229 | 1/20 | 0.47 |
| ▸ | KDM4C | Q9H3R0 | 1/20 | 0.47 |
| ▸ | KDM2A | Q9Y2K7 | 1/20 | 0.47 |
| ▸ | KDM3A | Q9Y4C1 | 1/20 | 0.47 |
| ▸ | GBA1 | P04062 | 1/20 | 0.46 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.46 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.45 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.45 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.45 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.45 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.45 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.45 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.45 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.45 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.45 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL4959659 | 0.83 | CYP19A1 (0.56) | P2RX7HRH4NPC1RAB9ACYP19A1 | |
| SCHEMBL28660008 | 0.76 | HDAC2 (0.48) | KDM4EKDM6BKDM4AKDM5CKDM4C | |
| SCHEMBL28621784 | 0.76 | HDAC2 (0.48) | KDM4EKDM6BKDM4AKDM5CKDM4C | |
| SCHEMBL28060209 | 0.75 | HDAC1 (0.45) | HDAC3HDAC4HDAC1HDAC7HDAC2 | |
| SCHEMBL8621793 | 0.75 | GBA1 (0.49) | KDM4EKDM6BKDM4AKDM5CKDM4C | |
| SCHEMBL16906517 | 0.75 | MAOB (0.51) | KDM4EKDM6BKDM4AKDM5CKDM4C | |
| SCHEMBL16401668 | 0.75 | GBA1 (0.52) | KDM4EKDM6BKDM4AKDM5CKDM4C | |
| SCHEMBL17336926 | 0.74 | KDM4E (0.60) | KDM4EKDM6BKDM4AKDM5CKDM4C | |
| SCHEMBL24569915 | 0.74 | P2RX7 (0.42) | P2RX7GBA1 | |
| SCHEMBL4964421 | 0.74 | HSP90AB1 (0.52) | P2RX7KDM4ENPC1RAB9A |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-109096211-B | Preparation method of polysubstituted triazole derivative | 华侨大学 | 2021-11-23 | — | — | CN | disclosed |
| CN-109096211-A | A kind of preparation method of polysubstituted triazole derivatives | 华侨大学 | 2018-12-28 | — | — | CN | disclosed |
| CN-105439966-A | Compounds, and preparation method and application thereof | UNIV HUAZHONG | 2016-03-30 | — | — | CN | disclosed |