Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE2A | O00408 | 1/20 | 0.42 |
| ▸ | PNMT | P11086 | 1/20 | 0.41 |
| ▸ | KRAS | P01116 | 2/20 | 0.39 |
| ▸ | SOS1 | Q07889 | 2/20 | 0.39 |
| ▸ | HTR2A | P28223 | 2/20 | 0.39 |
| ▸ | HTR2B | P41595 | 2/20 | 0.39 |
| ▸ | HTR2C | P28335 | 1/20 | 0.39 |
| ▸ | IDO1 | P14902 | 1/20 | 0.36 |
| ▸ | TDO2 | P48775 | 1/20 | 0.36 |
| ▸ | PTPN5 | P54829 | 1/20 | 0.36 |
| ▸ | CES2 | O00748 | 1/20 | 0.36 |
| ▸ | ACP3 | P15309 | 1/20 | 0.36 |
| ▸ | TACR1 | P25103 | 1/20 | 0.35 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.35 |
| ▸ | DAO | P14920 | 1/20 | 0.35 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.35 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.35 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.34 |
| ▸ | MIF | P14174 | 1/20 | 0.34 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL23590859 | 1.00 | PDE2A (0.42) | PDE2APNMTKRASSOS1HTR2A | |
| Hydrochloric Acid SCHEMBL29723346 | 0.98 | PDE2A (0.41) | PDE2APNMTKRASSOS1HTR2A | |
| Hydrochloric Acid SCHEMBL28839482 | 0.98 | PDE2A (0.41) | PDE2APNMTKRASSOS1HTR2A | |
| SCHEMBL25094472 | 0.86 | PTPN5 (0.48) | PNMTKRASSOS1IDO1TDO2 | |
| SCHEMBL840852 | 0.84 | PDE2A (0.46) | PDE2APNMTHTR2AHTR2BHTR2C | |
| SCHEMBL861038 | 0.84 | PDE2A (0.46) | PDE2APNMTHTR2AHTR2BHTR2C | |
| SCHEMBL23520737 | 0.82 | PDE2A (0.39) | PDE2APNMTHTR2AHTR2BHTR2C | |
| SCHEMBL18266127 | 0.82 | PDE2A (0.47) | PDE2APNMTHTR2AHTR2BHTR2C | |
| SCHEMBL29755328 | 0.82 | PDE2A (0.47) | PDE2APNMTHTR2AHTR2BHTR2C | |
| SCHEMBL18266126 | 0.82 | PDE2A (0.47) | PDE2APNMTHTR2AHTR2BHTR2C |
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 |
|---|---|---|---|---|---|---|---|
| CN-114685488-A | Compounds as SOS1 inhibitors and uses thereof | 南京圣和药业股份有限公司 | 2022-07-01 | — | — | CN | disclosed |