Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ITGB3 | P05106 | 1/20 | 0.55 |
| ▸ | ITGA2B | P08514 | 1/20 | 0.55 |
| ▸ | MEN1 | O00255 | 3/20 | 0.54 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.54 |
| ▸ | POLB | P06746 | 2/20 | 0.54 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.54 |
| ▸ | USP2 | O75604 | 1/20 | 0.54 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.54 |
| ▸ | MAPT | P10636 | 1/20 | 0.54 |
| ▸ | HPGD | P15428 | 1/20 | 0.54 |
| ▸ | BLM | P54132 | 1/20 | 0.54 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.54 |
| ▸ | AURKA | O14965 | 1/20 | 0.54 |
| ▸ | DAPK3 | O43293 | 1/20 | 0.54 |
| ▸ | JAK2 | O60674 | 1/20 | 0.54 |
| ▸ | PRKD3 | O94806 | 1/20 | 0.54 |
| ▸ | PAK4 | O96013 | 1/20 | 0.54 |
| ▸ | ABL1 | P00519 | 1/20 | 0.54 |
| ▸ | NTRK1 | P04629 | 1/20 | 0.54 |
| ▸ | LCK | P06239 | 1/20 | 0.54 |
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 | |
|---|---|---|---|---|
| SCHEMBL1383637 | 0.85 | GAA (0.56) | MEN1KMT2AKDM4EALDH1A1MAPT | |
| SCHEMBL10396194 | 0.84 | POLB (0.56) | MEN1KMT2APOLBKDM4EUSP2 | |
| Hydrochloric Acid SCHEMBL3976781 | 0.83 | GAA (0.54) | MEN1KMT2AKDM4EALDH1A1MAPT | |
| SCHEMBL532030 | 0.83 | HTT (0.73) | ITGB3ITGA2BMEN1KMT2APOLB | |
| SCHEMBL8576378 | 0.83 | POLB (0.56) | MEN1KMT2APOLBKDM4EUSP2 | |
| SCHEMBL12913021 | 0.82 | ADRB1 (0.56) | MEN1KMT2APOLBKDM4EUSP2 | |
| SCHEMBL14365681 | 0.82 | CNR1 (0.53) | MEN1KMT2APOLBKDM4EUSP2 | |
| Hydrochloric Acid SCHEMBL6528621 | 0.82 | HTR6 (0.58) | MEN1KMT2APOLBKDM4EUSP2 | |
| SCHEMBL22169762 | 0.81 | MAPT (0.52) | POLBALDH1A1MAPTJAK2HTT | |
| SCHEMBL1382777 | 0.81 | ABL1 (0.57) | ITGB3ITGA2BMEN1KMT2AUSP2 |
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-105849096-B | Piperidine derivatives having multimodal activity against pain | 埃斯蒂文制药股份有限公司 | 2019-11-29 | — | — | CN | disclosed |
| CN-105849096-A | Piperidine derivatives having multimodal activity against pain | 埃斯蒂文博士实验室股份有限公司 | 2016-08-10 | — | — | CN | disclosed |