Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GPR35 | Q9HC97 | 8/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | GSK3B | P49841 | 2/20 | 0.36 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.34 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | PKM | P14618 | 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 | |
|---|---|---|---|---|
| SCHEMBL23485282 | 0.81 | GPR35 (0.36) | GPR35ALDH1A1L3MBTL1ESR2TDP1 | |
| SCHEMBL11481751 | 0.79 | TDP1 (0.46) | GPR35ALDH1A1L3MBTL1ESR2TSHR | |
| SCHEMBL28866506 | 0.79 | COMT (0.46) | ALDH1A1L3MBTL1TSHRCYP1A2CYP2C19 | |
| SCHEMBL16737142 | 0.76 | ESR2 (0.41) | GPR35ALDH1A1L3MBTL1GSK3BESR2 | |
| SCHEMBL4584130 | 0.70 | GSK3B (0.59) | GPR35L3MBTL1GSK3BTSHRTDP1 | |
| SCHEMBL3281960 | 0.69 | GPR35 (0.47) | GPR35L3MBTL1GSK3BTSHRTDP1 | |
| SCHEMBL1973884 | 0.69 | GPR35 (0.47) | GPR35L3MBTL1GSK3BTSHRTDP1 | |
| SCHEMBL1475958 | 0.68 | CA1 (0.42) | GPR35ALDH1A1L3MBTL1TSHRTDP1 | |
| SCHEMBL6593908 | 0.68 | TSHR (0.46) | GPR35ALDH1A1L3MBTL1ESR2TSHR | |
| SCHEMBL16737121 | 0.68 | GPR35 (0.36) | GPR35ALDH1A1L3MBTL1GSK3BESR2 |
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-108884066-B | 2, 3, 5-substituted thiophene compounds as protein kinase inhibitors | 韩国科学技术研究院 | 2021-08-24 | — | — | CN | disclosed |
| CN-108884066-A | The thiophene compound that new 2,3,5- as kinases inhibitor replace | 韩国科学技术研究院 | 2018-11-23 | — | — | CN | disclosed |