Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HPGDS | O60760 | 1/20 | 0.46 |
| ▸ | GPR119 | Q8TDV5 | 3/20 | 0.43 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.43 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.43 |
| ▸ | TP53 | P04637 | 2/20 | 0.42 |
| ▸ | CHRM3 | P20309 | 7/20 | 0.41 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.41 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.41 |
| ▸ | PTPN2 | P17706 | 1/20 | 0.41 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.41 |
| ▸ | PTPN6 | P29350 | 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 | |
|---|---|---|---|---|
| SCHEMBL19088797 | 0.90 | PTPN2 (0.47) | GPR119HDAC1HDAC2PTPN2PTPN1 | |
| SCHEMBL19088794 | 0.89 | STS (0.47) | GPR119TP53CHRM3CHRM2CHRM1 | |
| SCHEMBL19066214 | 0.89 | CHRM3 (0.48) | GPR119CHRM3PTPN2PTPN1PTPN6 | |
| SCHEMBL19088791 | 0.84 | CHRM3 (0.45) | GPR119CHRM3 | |
| SCHEMBL19088795 | 0.80 | CHRM3 (0.53) | HDAC1HDAC2CHRM3CHRM2CHRM1 | |
| SCHEMBL19088803 | 0.79 | PTPN2 (0.46) | GPR119PTPN2PTPN1PTPN6 | |
| SCHEMBL4983940 | 0.78 | GPR119 (0.48) | HPGDSGPR119HDAC1HDAC2CHRM3 | |
| SCHEMBL14228062 | 0.78 | HPGDS (0.45) | HPGDSGPR119HDAC1HDAC2CHRM3 | |
| SCHEMBL19066183 | 0.77 | CHRM3 (0.50) | GPR119CHRM3PTPN2PTPN1PTPN6 | |
| SCHEMBL24906656 | 0.75 | CHRM3 (0.70) | CHRM3 |
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-107849035-B | Phenyl heterocyclic derivative and application thereof in medicine | 四川海思科制药有限公司 | 2021-12-10 | — | — | CN | disclosed |
| CN-107849035-A | Phenyl heterocyclic derivative and application thereof in medicine | 四川海思科制药有限公司 | 2018-03-27 | — | — | CN | disclosed |
| WO-2017114377-A1 | BENZYL HETEROCYCLIC COMPOUND DERIVATIVE AND PHARMACEUTICAL APPLICATION THEREOF | 四川海思科制药有限公司 | 2017-07-06 | — | — | WO | disclosed |