Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR6 | P50406 | 2/20 | 0.47 |
| ▸ | ESR1 | P03372 | 3/20 | 0.44 |
| ▸ | ESR2 | Q92731 | 3/20 | 0.44 |
| ▸ | NOS3 | P29474 | 1/20 | 0.44 |
| ▸ | NOS1 | P29475 | 1/20 | 0.44 |
| ▸ | NOS2 | P35228 | 1/20 | 0.44 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.44 |
| ▸ | GID4 | Q8IVV7 | 1/20 | 0.43 |
| ▸ | SIGMAR1 | Q99720 | 3/20 | 0.41 |
| ▸ | DDB1 | Q16531 | 1/20 | 0.38 |
| ▸ | CRBN | Q96SW2 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL644078 | 0.76 | HTR6 (0.61) | HTR6ESR1ESR2NOS3NOS1 | |
| SCHEMBL29117066 | 0.72 | SIGMAR1 (0.43) | ADRA2ASIGMAR1 | |
| SCHEMBL29117084 | 0.72 | SIGMAR1 (0.43) | ADRA2ASIGMAR1 | |
| SCHEMBL29117081 | 0.72 | SIGMAR1 (0.43) | ADRA2ASIGMAR1 | |
| SCHEMBL7327615 | 0.72 | ADRA2A (0.51) | ADRA2AGID4 | |
| SCHEMBL7012015 | 0.70 | ADRA2A (0.50) | ADRA2AGID4 | |
| SCHEMBL7216035 | 0.69 | ADRA2A (0.45) | HTR6ESR1ESR2ADRA2AGID4 | |
| SCHEMBL11120519 | 0.69 | GID4 (0.41) | HTR6ESR1ESR2ADRA2AGID4 | |
| SCHEMBL23056654 | 0.68 | PTGS2 (0.59) | NOS3NOS1NOS2SIGMAR1DDB1 | |
| SCHEMBL9311027 | 0.68 | HTR6 (0.75) | HTR6ESR1ESR2DDB1CRBN |
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-118047784-A | Small molecule compound with substituted phenyl spiro [ indoline-3, 3' -pyrrolidine ] structure | 中国科学院上海药物研究所 | 2024-05-17 | — | — | CN | disclosed |