Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RPS6KA5 | O75582 | 5/20 | 0.53 |
| ▸ | HTR2A | P28223 | 1/20 | 0.41 |
| ▸ | HTR2C | P28335 | 1/20 | 0.41 |
| ▸ | RPS6KA4 | O75676 | 1/20 | 0.40 |
| ▸ | ALKBH5 | Q6P6C2 | 1/20 | 0.37 |
| ▸ | FTO | Q9C0B1 | 1/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.37 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.37 |
| ▸ | BLM | P54132 | 1/20 | 0.36 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.35 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | FABP4 | P15090 | 1/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.34 |
| ▸ | NOS3 | P29474 | 1/20 | 0.34 |
| ▸ | NOS1 | P29475 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL28460368 | 0.81 | POLB (0.46) | RPS6KA5HTR2AHTR2CALKBH5FTO | |
| SCHEMBL28335263 | 0.79 | RPS6KA5 (0.53) | RPS6KA5RPS6KA4CYP1A2CYP2A6HSP90AA1 | |
| SCHEMBL28335134 | 0.79 | RPS6KA5 (0.53) | RPS6KA5HTR2AHTR2CRPS6KA4FABP4 | |
| SCHEMBL3300423 | 0.79 | RPS6KA5 (0.53) | RPS6KA5RPS6KA4CYP1A2CYP3A4CYP2C9 | |
| SCHEMBL28901199 | 0.79 | RPS6KA5 (0.53) | RPS6KA5RPS6KA4NOS1NPC1HSP90AA1 | |
| SCHEMBL29961184 | 0.79 | RPS6KA5 (0.53) | RPS6KA5RPS6KA4CYP1A2CYP3A4CYP2C9 | |
| SCHEMBL28337545 | 0.78 | RPS6KA5 (0.53) | RPS6KA5HTR2CRPS6KA4FABP4GRM1 | |
| SCHEMBL28419807 | 0.76 | SLC6A2 (0.45) | RPS6KA5ALKBH5FTOSLC6A2HTT | |
| SCHEMBL25662730 | 0.74 | HTR2A (0.44) | HTR2AHTR2CALKBH5FTOCYP1A2 | |
| SCHEMBL15831260 | 0.73 | ROCK1 (0.62) | — |
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 9 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-112047870-B | Preparation method of 7-alkyl indole derivative | 浙江工业大学 | 2021-10-12 | — | — | CN | claimed |
| CN-112047870-A | Preparation method of 7-alkyl indole derivative | 浙江工业大学 | 2020-12-08 | — | — | CN | claimed |
| CN-109678810-B | 1,2-oxygen nitrogen heterocyclic butane compound and preparation method and application thereof | 南京工业大学 | 2022-10-28 | — | — | CN | disclosed |
| CN-110563701-B | N-2-pyrimidine-2-azido-3- (2,2,6, 6-tetramethylpiperidinyloxy) indoline and preparation and application thereof | 浙江工业大学 | 2022-09-16 | — | — | CN | disclosed |
| CN-113307804-B | Synthetic method and application of fluorine-containing indole quinoline compound | 天津师范大学 | 2022-06-24 | — | — | CN | disclosed |
| CN-112047870-B | Preparation method of 7-alkyl indole derivative | 浙江工业大学 | 2021-10-12 | — | — | CN | disclosed |
| CN-112047870-A | Preparation method of 7-alkyl indole derivative | 浙江工业大学 | 2020-12-08 | — | — | CN | disclosed |
| CN-106279236-B | Method for synthesizing 2-triisopropyl silicon-based acetylene indole compound | 南京理工大学 | 2020-04-10 | — | — | CN | disclosed |
| CN-110563701-A | N-2-pyrimidine-2-azido-3- (2,2,6, 6-tetramethylpiperidinyloxy) indoline and preparation and application thereof | 浙江工业大学 | 2019-12-13 | — | — | CN | disclosed |