Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | F11 | P03951 | 1/20 | 0.67 |
| ▸ | DAO | P14920 | 2/20 | 0.61 |
| ▸ | GRIN2D | O15399 | 1/20 | 0.57 |
| ▸ | GRIN3B | O60391 | 1/20 | 0.57 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.57 |
| ▸ | GRIN2A | Q12879 | 1/20 | 0.57 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.57 |
| ▸ | GRIN2C | Q14957 | 1/20 | 0.57 |
| ▸ | GRIN3A | Q8TCU5 | 1/20 | 0.57 |
| ▸ | F7 | P08709 | 2/20 | 0.47 |
| ▸ | F3 | P13726 | 2/20 | 0.47 |
| ▸ | LTA4H | P09960 | 1/20 | 0.47 |
| ▸ | AHR | P35869 | 1/20 | 0.47 |
| ▸ | NR4A2 | P43354 | 1/20 | 0.47 |
| ▸ | PARP1 | P09874 | 1/20 | 0.46 |
| ▸ | CDK5 | Q00535 | 1/20 | 0.45 |
| ▸ | CDK5R1 | Q15078 | 1/20 | 0.45 |
| ▸ | LOXL2 | Q9Y4K0 | 1/20 | 0.44 |
| ▸ | IDH1 | O75874 | 2/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL8872186 | 0.86 | DAO (0.62) | F11DAOGRIN2DGRIN3BGRIN1 | |
| SCHEMBL1052487 | 0.80 | F11 (1.00) | F11DAOGRIN2DGRIN3BGRIN1 | |
| SCHEMBL10140668 | 0.76 | DAO (0.64) | F11DAOGRIN2DGRIN3BGRIN1 | |
| SCHEMBL16767857 | 0.76 | DAO (1.00) | F11DAOGRIN2DGRIN3BGRIN1 | |
| SCHEMBL31143054 | 0.76 | DAO (0.64) | F11DAOGRIN2DGRIN3BGRIN1 | |
| SCHEMBL7882349 | 0.76 | DAO (0.64) | F11DAOGRIN2DGRIN3BGRIN1 | |
| SCHEMBL31378871 | 0.76 | DAO (0.64) | F11DAOGRIN2DGRIN3BGRIN1 | |
| SCHEMBL1367967 | 0.73 | DAO (0.65) | F11DAOGRIN2DGRIN3BGRIN1 | |
| SCHEMBL830009 | 0.73 | DAO (0.60) | F11DAOGRIN2DGRIN3BGRIN1 | |
| SCHEMBL22185938 | 0.73 | DAO (0.60) | F11DAOGRIN2DGRIN3BGRIN1 |
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-117756717-A | Tolvaptan intermediate and preparation method of tollvaptan | 广州市桐晖药业有限公司 | 2024-03-26 | — | — | CN | disclosed |