Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA2 | P00918 | 1/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.39 |
| ▸ | DAO | P14920 | 4/20 | 0.39 |
| ▸ | NOTUM | Q6P988 | 7/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.37 |
| ▸ | HTT | P42858 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | HPGD | P15428 | 1/20 | 0.37 |
| ▸ | VHL | P40337 | 1/20 | 0.37 |
| ▸ | ELOC | Q15369 | 1/20 | 0.37 |
| ▸ | ELOB | Q15370 | 1/20 | 0.37 |
| ▸ | GPR35 | Q9HC97 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | FOLH1 | Q04609 | 1/20 | 0.34 |
| ▸ | GLA | P06280 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL28345538 | 0.81 | CA2 (0.47) | CA2ALDH1A1KDM4EHTTVHL | |
| SCHEMBL28398287 | 0.77 | CA2 (0.43) | CA2ALDH1A1KDM4EHTTHPGD | |
| SCHEMBL28406838 | 0.77 | ALDH1A1 (0.49) | CA2ALDH1A1KDM4EHTTLMNA | |
| SCHEMBL28401581 | 0.77 | CA2 (0.43) | CA2ALDH1A1KDM4EHTTLMNA | |
| SCHEMBL9459054 | 0.77 | ALDH1A1 (0.50) | ALDH1A1DAONOTUMKDM4ELMNA | |
| SCHEMBL28348405 | 0.75 | HRH4 (0.47) | CA2ALDH1A1KDM4ELMNAHPGD | |
| SCHEMBL28400986 | 0.75 | HPGD (0.50) | CA2ALDH1A1KDM4EHPGDMAPT | |
| SCHEMBL28393540 | 0.74 | KMT2A (0.55) | ALDH1A1HTTLMNAHPGDMEN1 | |
| SCHEMBL28399264 | 0.73 | RAB9A (0.47) | CA2ALDH1A1KDM4EHTTHPGD | |
| SCHEMBL28402762 | 0.73 | MAPT (0.52) | CA2ALDH1A1KDM4EHTTLMNA |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-108586484-B | Thienopyran carboxamides and their use | 沈阳药科大学 | 2020-05-15 | — | — | CN | disclosed |
| CN-108586485-B | 1- (4-hydroxyiminothieno [2,3-b ] thiopyranoformyl) piperazine compound and application thereof | 沈阳药科大学 | 2020-05-15 | — | — | CN | disclosed |
| CN-108822126-B | Thienopyran formyl piperazine compound and medical application thereof | 沈阳药科大学 | 2020-05-15 | — | — | CN | disclosed |
| CN-108822127-B | 4-hydroxyiminothieno [2,3-b ] thiopyran-2-carboxamides and their use | 沈阳药科大学 | 2020-05-15 | — | — | CN | disclosed |
| CN-108822125-B | 1- (thieno [2,3-b ] thiopyranoformyl) -4-aliphatic alkyl piperazine compound and medical application thereof | 沈阳药科大学 | 2020-01-31 | — | — | CN | disclosed |