Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 3/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | GAA | P10253 | 1/20 | 0.43 |
| ▸ | RECQL | P46063 | 1/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.42 |
| ▸ | SRC | P12931 | 2/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.41 |
| ▸ | CA1 | P00915 | 1/20 | 0.41 |
| ▸ | MMP2 | P08253 | 1/20 | 0.41 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.41 |
| ▸ | MAOB | P27338 | 5/20 | 0.41 |
| ▸ | CRHBP | P24387 | 1/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL505384 | 0.86 | CYP2C19 (0.50) | SMN1; SMN2CYP2C19MAPTGAASRC | |
| SCHEMBL18037096 | 0.85 | SRC (0.58) | ALDH1A1SMN1; SMN2CYP2C19MAPTCYP1A2 | |
| SCHEMBL31490212 | 0.85 | SRC (0.44) | ALDH1A1SMN1; SMN2CYP2C19MAPTCYP1A2 | |
| SCHEMBL28033998 | 0.85 | ALDH1A1 (0.46) | ALDH1A1SMN1; SMN2MAPTCYP1A2GAA | |
| SCHEMBL28982273 | 0.82 | MAPT (0.41) | ALDH1A1SMN1; SMN2CYP2C19MAPTCYP1A2 | |
| SCHEMBL9656228 | 0.80 | KMT2A (0.46) | ALDH1A1SMN1; SMN2CYP2C19MAPTCYP1A2 | |
| SCHEMBL5081897 | 0.80 | NCEH1 (0.50) | ALDH1A1SMN1; SMN2CYP2C19MAPTCYP1A2 | |
| SCHEMBL28074475 | 0.79 | HCRTR1 (0.54) | ALDH1A1SMN1; SMN2CYP2C19GAASRC | |
| SCHEMBL2910659 | 0.79 | CYP3A4 (0.52) | ALDH1A1SMN1; SMN2CYP2C19HSD17B10SRC | |
| SCHEMBL28074474 | 0.78 | NPC1 (0.47) | ALDH1A1SMN1; SMN2CYP2C19SRCKDM4E |
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-104744510-B | Alizarin aminophosphonate ester derivatives and synthetic method thereof and application | 广西师范大学 | 2016-08-17 | — | — | CN | claimed |
| CN-104744510-B | Alizarin aminophosphonate ester derivatives and synthetic method thereof and application | 广西师范大学 | 2016-08-17 | — | — | CN | disclosed |