Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.42 |
| ▸ | POLB | P06746 | 2/20 | 0.42 |
| ▸ | HTT | P42858 | 2/20 | 0.42 |
| ▸ | NPC1 | O15118 | 1/20 | 0.42 |
| ▸ | RAB9A | P51151 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.37 |
| ▸ | ATM | Q13315 | 1/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.37 |
| ▸ | CACNA2D1 | P54289 | 2/20 | 0.36 |
| ▸ | CACNA1B | Q00975 | 2/20 | 0.36 |
| ▸ | CACNB1 | Q02641 | 2/20 | 0.36 |
| ▸ | CACNA1C | Q13936 | 2/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | TRPM8 | Q7Z2W7 | 1/20 | 0.35 |
| ▸ | CXCL8 | P10145 | 1/20 | 0.35 |
| ▸ | CES2 | O00748 | 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 | |
|---|---|---|---|---|
| SCHEMBL2097502 | 0.82 | NPSR1 (0.50) | NPSR1ALDH1A1POLBHTTNPC1 | |
| SCHEMBL2097499 | 0.80 | NPSR1 (0.48) | NPSR1ALDH1A1POLBHTTNPC1 | |
| SCHEMBL28215851 | 0.79 | KMT2A (0.53) | NPSR1ALDH1A1POLBHTTNPC1 | |
| SCHEMBL9640442 | 0.76 | NPC1 (0.70) | NPSR1ALDH1A1POLBHTTNPC1 | |
| SCHEMBL25274260 | 0.76 | ALDH1A1 (0.50) | NPSR1ALDH1A1POLBHTTNPC1 | |
| SCHEMBL5814863 | 0.75 | ALDH1A1 (0.49) | NPSR1ALDH1A1POLBHTTNPC1 | |
| SCHEMBL5814868 | 0.75 | ALDH1A1 (0.49) | NPSR1ALDH1A1POLBHTTNPC1 | |
| SCHEMBL11224556 | 0.72 | ALDH1A1 (0.46) | NPSR1ALDH1A1POLBHTTNPC1 | |
| SCHEMBL9138844 | 0.68 | NPSR1 (0.52) | NPSR1ALDH1A1POLBHTTNPC1 | |
| SCHEMBL9471241 | 0.68 | NPSR1 (0.52) | NPSR1ALDH1A1POLBHTTNPC1 |
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-116836102-A | Method for preparing sodium diclofenac chloro impurity (3-chloro-N- (2, 6-dichlorophenyl) indol-2-one) | 河南东泰制药有限公司 | 2023-10-03 | — | — | CN | disclosed |