Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE7A | Q13946 | 4/20 | 0.47 |
| ▸ | ERN1 | O75460 | 1/20 | 0.44 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 3/20 | 0.40 |
| ▸ | MAPT | P10636 | 3/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.40 |
| ▸ | HDAC3 | O15379 | 3/20 | 0.40 |
| ▸ | HDAC1 | Q13547 | 3/20 | 0.40 |
| ▸ | HDAC2 | Q92769 | 3/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | LTA4H | P09960 | 1/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.38 |
| ▸ | EIF4E | P06730 | 1/20 | 0.38 |
| ▸ | PTGES | O14684 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL29465715 | 0.84 | KCNH2 (0.62) | ERN1KCNH2TDP1TSHRMEN1 | |
| SCHEMBL1065088 | 0.84 | KCNH2 (0.62) | ERN1KCNH2TDP1TSHRMEN1 | |
| SCHEMBL11725622 | 0.82 | PDE7A (0.52) | PDE7ATDP1TSHRMEN1MAPT | |
| SCHEMBL31339103 | 0.82 | PDE7A (0.40) | PDE7AERN1TDP1TSHRMEN1 | |
| SCHEMBL26108642 | 0.82 | PDE7A (0.40) | PDE7AERN1TDP1TSHRMEN1 | |
| SCHEMBL24359561 | 0.82 | KCNH2 (0.67) | KCNH2HDAC3HDAC1HDAC2LTA4H | |
| SCHEMBL29600798 | 0.82 | KCNH2 (0.67) | KCNH2HDAC3HDAC1HDAC2LTA4H | |
| SCHEMBL29053000 | 0.81 | ABCB1 (0.41) | PDE7AERN1MEN1MAPTKMT2A | |
| SCHEMBL30468957 | 0.80 | PDE7A (0.48) | PDE7AERN1KCNH2TDP1TSHR | |
| SCHEMBL2419394 | 0.80 | PDE7A (0.56) | PDE7ATDP1TSHRMEN1MAPT |
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-116348114-A | Thiobenzimidazole derivatives or pharmaceutically acceptable salts thereof and use thereof | 高丽大学校产学协力团 | 2023-06-27 | — | — | CN | disclosed |
| WO-2022086110-A1 | THIOBENZIMIDAZOLE DERIVATIVE OR PHARMACEUTICALLY ACCEPTABLE SALT THEREOF AND USE THEREOF | 고려대학교 산학협력단 | 2022-04-28 | — | — | WO | disclosed |