Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C19 | P33261 | 1/20 | 0.61 |
| ▸ | CNR2 | P34972 | 4/20 | 0.55 |
| ▸ | TRPM8 | Q7Z2W7 | 1/20 | 0.48 |
| ▸ | TP53 | P04637 | 1/20 | 0.47 |
| ▸ | MAPT | P10636 | 1/20 | 0.47 |
| ▸ | TSPO | P30536 | 1/20 | 0.47 |
| ▸ | CNR1 | P21554 | 2/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.47 |
| ▸ | POLB | P06746 | 2/20 | 0.46 |
| ▸ | TSHR | P16473 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.46 |
| ▸ | LMNA | P02545 | 1/20 | 0.46 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.46 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.46 |
| ▸ | F2 | P00734 | 2/20 | 0.45 |
| ▸ | F10 | P00742 | 2/20 | 0.45 |
| ▸ | ITGB3 | P05106 | 2/20 | 0.45 |
| ▸ | ITGA2B | P08514 | 2/20 | 0.45 |
| ▸ | PPARG | P37231 | 1/20 | 0.45 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL17700288 | 0.93 | TSHR (0.54) | CYP2C19CNR2TP53TSPOSMN1; SMN2 | |
| SCHEMBL6774585 | 0.83 | CNR2 (0.43) | CYP2C19CNR2TP53MAPTTSPO | |
| SCHEMBL6485863 | 0.83 | TP53 (0.48) | CNR2TP53MAPTTSPOCNR1 | |
| SCHEMBL28565303 | 0.83 | CYP2C19 (0.71) | CYP2C19CNR2TSPOCNR1TSHR | |
| SCHEMBL6488084 | 0.82 | NR1H2 (0.67) | LMNA | |
| SCHEMBL28300064 | 0.82 | MAPT (0.48) | CNR2MAPTCNR1SMN1; SMN2POLB | |
| SCHEMBL8624227 | 0.81 | SMN1; SMN2 (0.57) | TP53MAPTSMN1; SMN2TSHRALDH1A1 | |
| SCHEMBL13657714 | 0.81 | ALDH1A1 (0.46) | TSPOPOLBALDH1A1LMNAHSD17B10 | |
| SCHEMBL6486223 | 0.80 | NR1H2 (0.54) | LMNA | |
| SCHEMBL3184733 | 0.80 | ALDH1A1 (0.54) | TP53MAPTSMN1; SMN2POLBTSHR |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-109776385-B | Preparation method of N-substituted isatin derivative | 浙江工业大学 | 2020-11-13 | — | — | CN | disclosed |
| CN-109776385-A | A kind of N- replaces the preparation method of Isatine derivatives | 浙江工业大学 | 2019-05-21 | — | — | CN | disclosed |