Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.52 |
| ▸ | CA2 | P00918 | 1/20 | 0.51 |
| ▸ | CA5A | P35218 | 1/20 | 0.51 |
| ▸ | GAA | P10253 | 9/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.49 |
| ▸ | POLB | P06746 | 4/20 | 0.49 |
| ▸ | LMNA | P02545 | 3/20 | 0.49 |
| ▸ | NPC1 | O15118 | 3/20 | 0.49 |
| ▸ | AGTR1 | P30556 | 1/20 | 0.49 |
| ▸ | MAPT | P10636 | 7/20 | 0.49 |
| ▸ | GLA | P06280 | 1/20 | 0.49 |
| ▸ | MAOA | P21397 | 1/20 | 0.47 |
| ▸ | GRIN2D | O15399 | 1/20 | 0.46 |
| ▸ | GRIN3B | O60391 | 1/20 | 0.46 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.46 |
| ▸ | GRIN2A | Q12879 | 1/20 | 0.46 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.46 |
| ▸ | GRIN2C | Q14957 | 1/20 | 0.46 |
| ▸ | GRIN3A | Q8TCU5 | 1/20 | 0.46 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL667827 | 0.83 | CA2 (0.67) | CA2CA5AGAAALDH1A1POLB | |
| SCHEMBL28253803 | 0.82 | CA2 (0.53) | CA2CA5AGAAALDH1A1POLB | |
| SCHEMBL2300811 | 0.80 | GRIN2D (0.58) | SMN1; SMN2GAAALDH1A1POLBNPC1 | |
| SCHEMBL1520890 | 0.78 | GAA (0.61) | SMN1; SMN2CA2CA5AGAAALDH1A1 | |
| SCHEMBL28916359 | 0.77 | CA2 (0.60) | SMN1; SMN2CA2CA5AGAAALDH1A1 | |
| SCHEMBL20984105 | 0.76 | GAA (0.60) | SMN1; SMN2GAAALDH1A1POLBLMNA | |
| SCHEMBL9011618 | 0.75 | SMN1; SMN2 (0.61) | SMN1; SMN2CA2GAAALDH1A1POLB | |
| SCHEMBL26735733 | 0.74 | ALDH1A1 (0.45) | SMN1; SMN2GAAALDH1A1POLBLMNA | |
| SCHEMBL6680813 | 0.74 | CA2 (0.56) | CA2CA5AGAAALDH1A1POLB | |
| SCHEMBL7043304 | 0.74 | GAA (0.64) | CA2CA5AGAAALDH1A1LMNA |
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-110511168-A | A kind of N- substituent group benzaldehyde thiosemicarbazone analog derivative and its preparation method and application | UNIV NORTHWESTERN | 2019-11-29 | — | — | CN | claimed |
| CN-110511168-A | A kind of N- substituent group benzaldehyde thiosemicarbazone analog derivative and its preparation method and application | UNIV NORTHWESTERN | 2019-11-29 | — | — | CN | disclosed |