Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDCD1 | Q15116 | 2/20 | 0.40 |
| ▸ | CD274 | Q9NZQ7 | 2/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
| ▸ | HCAR1 | Q9BXC0 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | SETDB1 | Q15047 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.32 |
| ▸ | TP53 | P04637 | 1/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL1708065 | 0.78 | TSHR (0.59) | PDCD1CD274POLBTP53KDM4E | |
| SCHEMBL11166064 | 0.76 | PDCD1 (0.47) | PDCD1CD274GAAPOLBMEN1 | |
| SCHEMBL21621663 | 0.74 | ALDH1A1 (0.41) | PDCD1CD274HCAR1MEN1KMT2A | |
| SCHEMBL21621715 | 0.74 | NOTUM (0.50) | PDCD1CD274P2RX7TP53ALDH1A1 | |
| SCHEMBL10153084 | 0.73 | MAPK1 (0.47) | HCAR1MEN1KMT2AALDH1A1TSHR | |
| SCHEMBL1708275 | 0.70 | BMI1 (0.37) | HCAR1ALDH1A1TSHR | |
| SCHEMBL9454981 | 0.69 | PDCD1 (0.47) | PDCD1CD274GAAKMT2ATP53 | |
| SCHEMBL1708353 | 0.69 | L3MBTL1 (0.38) | PDCD1CD274ALDH1A1TSHR | |
| SCHEMBL10153088 | 0.69 | SORD (0.41) | PDCD1CD274MEN1KMT2AKDM4E | |
| SCHEMBL6424004 | 0.69 | PDCD1 (0.64) | PDCD1CD274MEN1KMT2A |
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 |
|---|---|---|---|---|---|---|---|
| WO-2020011246-A1 | BENZENE RING-CONTAINING COMPOUND, PREPARATION METHOD THEREFOR AND APPLICATION THEREOF | 广州丹康医药生物有限公司 | 2020-01-16 | — | — | WO | disclosed |