Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOTUM | Q6P988 | 1/20 | 0.50 |
| ▸ | TDP2 | O95551 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | MDM2 | Q00987 | 1/20 | 0.36 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.35 |
| ▸ | MAT2A | P31153 | 1/20 | 0.35 |
| ▸ | ATM | Q13315 | 1/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 2/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.35 |
| ▸ | PLA2G10 | O15496 | 1/20 | 0.35 |
| ▸ | VCP | P55072 | 1/20 | 0.34 |
| ▸ | GAA | P10253 | 2/20 | 0.34 |
| ▸ | GSK3A | P49840 | 1/20 | 0.34 |
| ▸ | GSK3B | P49841 | 1/20 | 0.34 |
| ▸ | TP53 | P04637 | 1/20 | 0.34 |
| ▸ | POLB | P06746 | 2/20 | 0.34 |
| ▸ | HTT | P42858 | 2/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL28202823 | 0.87 | ALDH1A1 (0.50) | NOTUMTDP2ALDH1A1TSHRPTGS1 | |
| SCHEMBL28885169 | 0.81 | NOTUM (0.47) | NOTUMTDP2ALDH1A1TSHRPTGS1 | |
| SCHEMBL28365127 | 0.80 | NOTUM (0.52) | NOTUMTDP2ALDH1A1TSHRMAT2A | |
| SCHEMBL28365266 | 0.80 | TDP2 (0.47) | NOTUMTDP2MAT2AL3MBTL1MEN1 | |
| SCHEMBL28365593 | 0.80 | NOTUM (0.49) | NOTUMALDH1A1PTGS1MAT2AMEN1 | |
| SCHEMBL28365129 | 0.80 | CYP19A1 (0.49) | NOTUMALDH1A1KDM4EMAT2AL3MBTL1 | |
| SCHEMBL28368790 | 0.80 | KDM4E (0.44) | NOTUMALDH1A1KDM4EMAT2AL3MBTL1 | |
| SCHEMBL28365057 | 0.76 | CYP19A1 (0.46) | NOTUMALDH1A1TSHRMDM2KDM4E | |
| SCHEMBL28369113 | 0.76 | CYP19A1 (0.52) | NOTUMTDP2ALDH1A1TSHRMAT2A | |
| SCHEMBL29870724 | 0.75 | MAPK1 (0.50) | NOTUMALDH1A1KDM4EMAT2AL3MBTL1 |
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-107619385-B | Method for synthesizing 2-trifluoromethyl indole by palladium-catalyzed aryl enamine intramolecular amine | 温州大学 | 2020-02-21 | — | — | CN | disclosed |