Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 2/20 | 0.45 |
| ▸ | CA1 | P00915 | 2/20 | 0.45 |
| ▸ | CA9 | Q16790 | 2/20 | 0.45 |
| ▸ | LIG1 | P18858 | 1/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.43 |
| ▸ | FLT3 | P36888 | 1/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | GAA | P10253 | 4/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | BLM | P54132 | 1/20 | 0.40 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.39 |
| ▸ | LMNA | P02545 | 2/20 | 0.39 |
| ▸ | HPGD | P15428 | 3/20 | 0.38 |
| ▸ | POLB | P06746 | 2/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL23535494 | 0.86 | HPGDS (0.51) | CA12CA1CA9LIG1KDM4E | |
| SCHEMBL406268 | 0.81 | HTT (0.49) | CA12CA9KDM4EGAAALDH1A1 | |
| SCHEMBL23535302 | 0.77 | HTT (0.60) | CA12CA9KDM4EGAAALDH1A1 | |
| SCHEMBL23535314 | 0.76 | IRAK4 (0.44) | CA12CA9KDM4EGAAALDH1A1 | |
| Bromide SCHEMBL23535143 | 0.76 | KMT2A (0.40) | CA12CA1CA9LIG1KDM4E | |
| SCHEMBL23535145 | 0.76 | PDE4B (0.39) | CA12CA1CA9LIG1KDM4E | |
| SCHEMBL23570165 | 0.75 | KDM4E (0.40) | LIG1KDM4EFLT3CYP3A4GAA | |
| SCHEMBL1319409 | 0.75 | LIG1 (0.67) | LIG1KDM4ECYP3A4GAAALDH1A1 | |
| SCHEMBL12641905 | 0.74 | CYP3A4 (0.41) | CA12CA1CA9LIG1KDM4E | |
| SCHEMBL3955768 | 0.73 | FLT3 (0.66) | KDM4EFLT3CYP3A4GAAALDH1A1 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2021125905-A1 | NOVEL THIAZOLE DERIVATIVE AND USE THEREOF | 가천대학교 산학협력단 | 2021-06-24 | — | — | WO | disclosed |