Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOS1 | P29475 | 2/20 | 0.36 |
| ▸ | NOS3 | P29474 | 1/20 | 0.36 |
| ▸ | NOS2 | P35228 | 1/20 | 0.36 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | SLC7A5 | Q01650 | 1/20 | 0.33 |
| ▸ | APLNR | P35414 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.32 |
| ▸ | LMNA | P02545 | 3/20 | 0.31 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.31 |
| ▸ | CA1 | P00915 | 1/20 | 0.31 |
| ▸ | CA2 | P00918 | 1/20 | 0.31 |
| ▸ | CA7 | P43166 | 1/20 | 0.31 |
| ▸ | DGAT1 | O75907 | 1/20 | 0.30 |
| ▸ | GAA | P10253 | 2/20 | 0.30 |
| ▸ | MEN1 | O00255 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL4281970 | 0.78 | ALOX15 (0.46) | ALOX15CYP1A2CYP2C9CYP2C19ALDH1A1 | |
| SCHEMBL1263505 | 0.77 | NOS1 (0.33) | NOS1NOS3NOS2ALOX15CYP1A2 | |
| SCHEMBL30068345 | 0.77 | CA1 (0.35) | NOS1NOS3NOS2ALOX15CYP1A2 | |
| SCHEMBL27930487 | 0.76 | NOS1 (0.35) | NOS1NOS3NOS2CYP1A2CYP2C9 | |
| SCHEMBL28292971 | 0.76 | — | — | |
| SCHEMBL29105306 | 0.75 | CYP1A2 (0.33) | NOS1NOS3NOS2ALOX15CYP1A2 | |
| SCHEMBL2886165 | 0.75 | CYP2C9 (0.40) | NOS1NOS3NOS2ALOX15CYP1A2 | |
| SCHEMBL1952044 | 0.74 | NOS1 (0.38) | NOS1NOS3NOS2ALOX15CYP1A2 | |
| SCHEMBL30458009 | 0.74 | NOS1 (0.38) | NOS1NOS3NOS2ALOX15CYP1A2 | |
| SCHEMBL78923 | 0.74 | NOS1 (0.38) | NOS1NOS3NOS2ALOX15CYP1A2 |
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-A | A kind of highly selective 4-(4- aminophenyl) morpholine -3- ketone synthetic method | 新发药业有限公司 | 2019-04-19 | — | — | CN | disclosed |