Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CACNA1F | O60840 | 1/20 | 0.41 |
| ▸ | CACNA1D | Q01668 | 1/20 | 0.41 |
| ▸ | CACNA1S | Q13698 | 1/20 | 0.41 |
| ▸ | CACNA1C | Q13936 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.40 |
| ▸ | MAPT | P10636 | 6/20 | 0.39 |
| ▸ | LMNA | P02545 | 4/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.39 |
| ▸ | HTR2A | P28223 | 1/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 3/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.39 |
| ▸ | THPO | P40225 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL28902447 | 0.87 | NPC1 (0.44) | KMT2AMAPTLMNAKDM4ENPC1 | |
| SCHEMBL28482763 | 0.86 | MAPT (0.49) | KMT2AMAPTLMNAKDM4ENPC1 | |
| SCHEMBL28486013 | 0.84 | ALDH1A1 (0.42) | KMT2AMAPTLMNAKDM4ENPC1 | |
| SCHEMBL28493048 | 0.82 | NPC1 (0.43) | KMT2AMAPTNPC1MEN1CYP3A4 | |
| SCHEMBL28489348 | 0.80 | KMT2A (0.43) | CACNA1FCACNA1DCACNA1SCACNA1CKMT2A | |
| SCHEMBL10434032 | 0.74 | NPC1 (0.46) | KMT2AMAPTLMNAKDM4EHTR2A | |
| SCHEMBL7055470 | 0.70 | MAPT (0.44) | KMT2AMAPTLMNAKDM4EHTR2A | |
| SCHEMBL15658606 | 0.70 | HTR2A (0.50) | KMT2AMAPTLMNAKDM4EHTR2A | |
| SCHEMBL22076554 | 0.69 | ALDH1A1 (0.54) | KMT2AMAPTLMNAKDM4ENPC1 | |
| SCHEMBL11515353 | 0.68 | ALDH1A1 (0.45) | MAPTNPC1ALDH1A1L3MBTL1CRHBP |
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-109651286-B | High-selectivity synthesis method of 4- (4-aminophenyl) morpholine-3-one | 新发药业有限公司 | 2020-08-11 | — | — | CN | disclosed |