Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTPN5 | P54829 | 1/20 | 0.34 |
| ▸ | GPR3 | P46089 | 1/20 | 0.34 |
| ▸ | AR | P10275 | 1/20 | 0.34 |
| ▸ | CES2 | O00748 | 2/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.32 |
| ▸ | PDE2A | O00408 | 1/20 | 0.31 |
| ▸ | KIF11 | P52732 | 3/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.31 |
| ▸ | HTR3E | A5X5Y0 | 1/20 | 0.31 |
| ▸ | HTR3B | O95264 | 1/20 | 0.31 |
| ▸ | HTR3A | P46098 | 1/20 | 0.31 |
| ▸ | HTR3D | Q70Z44 | 1/20 | 0.31 |
| ▸ | HTR3C | Q8WXA8 | 1/20 | 0.31 |
| ▸ | PKM | P14618 | 1/20 | 0.31 |
| ▸ | BACE1 | P56817 | 1/20 | 0.31 |
| ▸ | HPGD | P15428 | 1/20 | 0.31 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.31 |
| ▸ | METAP2 | P50579 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL29956599 | 0.78 | AR (0.46) | PTPN5GPR3ARCES2PDE2A | |
| SCHEMBL29956335 | 0.76 | PTPN5 (0.34) | PTPN5GPR3ARCES2TSHR | |
| SCHEMBL29954401 | 0.76 | PDE2A (0.44) | PTPN5GPR3TSHRPDE2AALDH1A1 | |
| SCHEMBL29955691 | 0.73 | IDO1 (0.41) | PTPN5CES2TSHRMAPK1PDE2A | |
| SCHEMBL29956146 | 0.73 | CES2 (0.46) | PTPN5GPR3ARCES2TSHR | |
| SCHEMBL7863217 | 0.73 | PTPN5 (0.41) | PTPN5GPR3CES2TSHRMAPK1 | |
| SCHEMBL29643309 | 0.72 | TAS2R14 (0.36) | PTPN5GPR3ARCES2TSHR | |
| SCHEMBL29954943 | 0.72 | PDE2A (0.41) | TSHRPDE2AALDH1A1 | |
| SCHEMBL319516 | 0.70 | IDO1 (0.44) | PTPN5CES2TSHRMAPK1PDE2A | |
| SCHEMBL31371267 | 0.70 | PTPN5 (0.39) | PTPN5GPR3CES2TSHRMAPK1 |
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-115025086-A | Bicyclic heteroaryl derivatives, their preparation and use | 凯瑞康宁生物工程（武汉）有限公司 | 2022-09-09 | — | — | CN | disclosed |
| CN-110709386-B | Bicyclic heteroaryl derivatives, their preparation and use | 凯瑞康宁生物工程（武汉）有限公司 | 2022-06-07 | — | — | CN | disclosed |