Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2A | P28223 | 1/20 | 0.39 |
| ▸ | HTR2C | P28335 | 1/20 | 0.39 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.39 |
| ▸ | POLB | P06746 | 4/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | MALT1 | Q9UDY8 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.36 |
| ▸ | PTGER1 | P34995 | 1/20 | 0.35 |
| ▸ | GRN | P28799 | 2/20 | 0.35 |
| ▸ | SORT1 | Q99523 | 2/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | CNR1 | P21554 | 1/20 | 0.35 |
| ▸ | ACHE | P22303 | 1/20 | 0.35 |
| ▸ | CNR2 | P34972 | 1/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.35 |
| ▸ | P2RY14 | Q15391 | 1/20 | 0.35 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL28113101 | 0.87 | HTR2A (0.36) | HTR2AHTR2CSLC6A4KDM4EMALT1 | |
| SCHEMBL17610952 | 0.87 | HTR2A (0.42) | HTR2AHTR2CSLC6A4KDM4EMALT1 | |
| SCHEMBL16796413 | 0.83 | P2RY14 (0.39) | HTR2AHTR2CSLC6A4SMN1; SMN2CYP2C19 | |
| SCHEMBL5120984 | 0.81 | SMN1; SMN2 (0.46) | HTR2AHTR2CSLC6A4POLBMALT1 | |
| SCHEMBL3262082 | 0.78 | HTR2A (0.44) | HTR2AHTR2CSLC6A4POLBKDM4E | |
| SCHEMBL10330274 | 0.78 | PTGER1 (0.49) | POLBKDM4EPTGER1CYP2C19P2RY14 | |
| SCHEMBL15075338 | 0.72 | SMN1; SMN2 (0.38) | POLBKDM4EMALT1SMN1; SMN2GRN | |
| SCHEMBL16796416 | 0.72 | TP53 (0.37) | HTR2AHTR2CSLC6A4SMN1; SMN2CYP2C19 | |
| SCHEMBL17611006 | 0.71 | P2RY14 (0.52) | POLBMALT1SMN1; SMN2PTGER1GRN | |
| SCHEMBL15075329 | 0.71 | BRD4 (0.40) | SMN1; SMN2MAPK1 |
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-106304835-A | Sgc stimulant | 铁木医药有限公司 | 2017-01-04 | — | — | CN | disclosed |