Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GPR35 | Q9HC97 | 7/20 | 0.45 |
| ▸ | GSK3B | P49841 | 2/20 | 0.37 |
| ▸ | DAO | P14920 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL1498222 | 0.82 | GSK3B (0.44) | GPR35GSK3BDAOTSHRCYP1A2 | |
| Hydrochloric Acid SCHEMBL28459433 | 0.80 | GSK3B (0.43) | GPR35GSK3BDAOTSHRCYP1A2 | |
| SCHEMBL15878019 | 0.76 | GSK3B (0.56) | GPR35GSK3BDAOTSHRCYP1A2 | |
| SCHEMBL19085034 | 0.74 | TSHR (0.42) | GPR35DAOTSHR | |
| SCHEMBL19342527 | 0.73 | GPR35 (0.51) | GPR35DAOTSHRALDH1A1KMT2A | |
| SCHEMBL3228565 | 0.70 | POLB (0.47) | GPR35DAOALDH1A1KMT2A | |
| SCHEMBL19712733 | 0.70 | GSK3B (0.36) | GPR35GSK3BDAOTSHRPTPN1 | |
| SCHEMBL19733065 | 0.67 | DAO (0.39) | GPR35GSK3BDAOTSHRCYP1A2 | |
| SCHEMBL1035933 | 0.65 | CYP1A2 (0.47) | GPR35DAOTSHRCYP1A2ALDH1A1 | |
| SCHEMBL7529954 | 0.65 | CYP1A2 (0.40) | GPR35DAOTSHRCYP1A2ALDH1A1 |
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-114736232-A | Diester-base bithiophene non-condensed ring electron acceptor material, preparation method and application | 江西师范大学 | 2022-07-12 | — | — | CN | claimed |
| CN-114736232-A | Diester-base bithiophene non-condensed ring electron acceptor material, preparation method and application | 江西师范大学 | 2022-07-12 | — | — | CN | disclosed |