Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOTUM | Q6P988 | 1/20 | 0.53 |
| ▸ | IDO1 | P14902 | 1/20 | 0.53 |
| ▸ | MAT2A | P31153 | 2/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.46 |
| ▸ | MEN1 | O00255 | 3/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.46 |
| ▸ | GAA | P10253 | 2/20 | 0.46 |
| ▸ | LMNA | P02545 | 2/20 | 0.46 |
| ▸ | MAPT | P10636 | 2/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.46 |
| ▸ | G6PD | P11413 | 1/20 | 0.46 |
| ▸ | TDO2 | P48775 | 1/20 | 0.44 |
| ▸ | CTDSP1 | Q9GZU7 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 3/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.41 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL14511117 | 0.79 | ADRA1A (0.48) | NOTUMALDH1A1MEN1KMT2AGAA | |
| SCHEMBL30908194 | 0.79 | ADRA1A (0.48) | NOTUMALDH1A1MEN1KMT2AGAA | |
| SCHEMBL11023550 | 0.79 | NOTUM (0.56) | NOTUMMAT2AALDH1A1MEN1KMT2A | |
| SCHEMBL30055522 | 0.79 | NOTUM (0.56) | NOTUMMAT2AALDH1A1MEN1KMT2A | |
| SCHEMBL15058948 | 0.76 | NOTUM (0.53) | NOTUMMAT2AALDH1A1MEN1KMT2A | |
| SCHEMBL30462819 | 0.76 | NOTUM (0.53) | NOTUMMAT2AALDH1A1MEN1KMT2A | |
| SCHEMBL30719692 | 0.76 | NOTUM (0.53) | NOTUMMAT2AALDH1A1MEN1KMT2A | |
| SCHEMBL1531523 | 0.76 | MAPK1 (0.56) | NOTUMMAT2AALDH1A1MEN1KMT2A | |
| SCHEMBL25025064 | 0.76 | KCNH2 (0.47) | ALDH1A1MEN1KMT2AGAALMNA | |
| SCHEMBL1196311 | 0.76 | NOTUM (0.49) | NOTUMMAT2AALDH1A1MEN1KMT2A |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-112851584-B | Non-activated beta-C (sp) in the synthesis of carboxylic acid derivatives 3 ) Method for nitrating-H bond | 南京理工大学 | 2022-11-25 | — | — | CN | claimed |
| CN-112851584-B | Non-activated beta-C (sp) in the synthesis of carboxylic acid derivatives 3 ) Method for nitrating-H bond | 南京理工大学 | 2022-11-25 | — | — | CN | disclosed |
| CN-112851584-A | Nitric acid esterification method for non-activated beta-C (sp3) -H bond in synthesis of carboxylic acid derivative | 南京理工大学 | 2021-05-28 | — | — | CN | disclosed |