Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GABRA1 | P14867 | 3/20 | 0.50 |
| ▸ | GABRG2 | P18507 | 2/20 | 0.50 |
| ▸ | GABRB3 | P28472 | 2/20 | 0.50 |
| ▸ | SLC6A2 | P23975 | 3/20 | 0.40 |
| ▸ | HTR2C | P28335 | 2/20 | 0.40 |
| ▸ | HTR2B | P41595 | 2/20 | 0.40 |
| ▸ | GABRB2 | P47870 | 2/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.40 |
| ▸ | LMNA | P02545 | 2/20 | 0.40 |
| ▸ | FAAH | O00519 | 1/20 | 0.40 |
| ▸ | CA1 | P00915 | 1/20 | 0.40 |
| ▸ | CA2 | P00918 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | GABRB1 | P18505 | 1/20 | 0.40 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.40 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.40 |
| ▸ | GABRA3 | P34903 | 1/20 | 0.40 |
| ▸ | GABRA2 | P47869 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL19290002 | 0.77 | GABRA1 (0.47) | GABRA1GABRG2GABRB3SLC6A2HTR2C | |
| SCHEMBL3842621 | 0.76 | GABRA1 (0.60) | GABRA1GABRG2GABRB3SLC6A2HTR2C | |
| SCHEMBL10391946 | 0.75 | SCN4A (0.40) | SLC6A2HTR2BCYP1A2CYP3A4LMNA | |
| SCHEMBL16273856 | 0.74 | GABRA1 (0.44) | GABRA1GABRG2GABRB3SLC6A2HTR2C | |
| SCHEMBL813655 | 0.74 | GABRA1 (0.41) | GABRA1GABRG2GABRB3SLC6A2HTR2C | |
| SCHEMBL813212 | 0.74 | GABRA1 (0.41) | GABRA1GABRG2GABRB3SLC6A2HTR2C | |
| SCHEMBL3844252 | 0.72 | GABRA1 (0.56) | GABRA1GABRG2GABRB3SLC6A2HTR2C | |
| SCHEMBL19289796 | 0.72 | GABRA1 (0.50) | GABRA1GABRG2GABRB3SLC6A2HTR2C | |
| SCHEMBL2511832 | 0.71 | TAAR1 (0.50) | SLC6A2HTR2CHTR2BCYP1A2CYP3A4 | |
| SCHEMBL1815884 | 0.71 | GABRA1 (0.43) | GABRA1GABRG2GABRB3SLC6A2HTR2C |
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-104628730-B | A kind of optical homochiral cyclic n nitroso compound, the synthetic method of N acetals | 中山大学 | 2018-01-30 | — | — | CN | disclosed |
| CN-104628730-A | Method for synthesizing optical pure chiral cyclic N,N-acetal | UNIV SUN YAT SEN | 2015-05-20 | — | — | CN | disclosed |
| CN-104311559-A | Synthetic method of optically pure chiral annular N, N-acetal | UNIV SUN YAT SEN | 2015-01-28 | — | — | CN | disclosed |