Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.43 |
| ▸ | TSHR | P16473 | 2/20 | 0.43 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.43 |
| ▸ | TYMS | P04818 | 1/20 | 0.41 |
| ▸ | CHEK2 | O96017 | 2/20 | 0.39 |
| ▸ | PDE7A | Q13946 | 2/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.37 |
| ▸ | MEN1 | O00255 | 2/20 | 0.37 |
| ▸ | MAPT | P10636 | 2/20 | 0.37 |
| ▸ | EPHB4 | P54760 | 1/20 | 0.36 |
| ▸ | FADS1 | O60427 | 1/20 | 0.35 |
| ▸ | MAPK13 | O15264 | 1/20 | 0.34 |
| ▸ | MAPK12 | P53778 | 1/20 | 0.34 |
| ▸ | MAPK11 | Q15759 | 1/20 | 0.34 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.34 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 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 | |
|---|---|---|---|---|
| SCHEMBL26111322 | 1.00 | ALDH1A1 (0.43) | ALDH1A1CYP3A4TSHRALOX15SMN1; SMN2 | |
| SCHEMBL613358 | 0.79 | CYP3A4 (0.48) | ALDH1A1CYP3A4TSHRALOX15SMN1; SMN2 | |
| SCHEMBL31339083 | 0.78 | PDE7A (0.61) | ALDH1A1TSHRTDP1PDE7AKMT2A | |
| SCHEMBL26109803 | 0.78 | PDE7A (0.61) | ALDH1A1TSHRTDP1PDE7AKMT2A | |
| SCHEMBL272102 | 0.78 | TSHR (0.54) | ALDH1A1CYP3A4TSHRALOX15SMN1; SMN2 | |
| SCHEMBL29053002 | 0.76 | MEN1 (0.49) | ALDH1A1CYP3A4TSHRALOX15SMN1; SMN2 | |
| SCHEMBL31339066 | 0.76 | ALDH1A1 (0.54) | ALDH1A1CYP3A4TSHRALOX15SMN1; SMN2 | |
| SCHEMBL4610392 | 0.76 | MAPT (0.53) | ALDH1A1CYP3A4TSHRALOX15PDE7A | |
| SCHEMBL5981668 | 0.73 | ALDH1A1 (0.54) | ALDH1A1CYP3A4TSHRSMN1; SMN2TDP1 | |
| SCHEMBL3926234 | 0.71 | HSD17B10 (0.45) | ALDH1A1TYMSCHEK2PDE7AKMT2A |
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-118974041-A | Thiobenzimidazole derivatives or pharmaceutically acceptable salts thereof and use thereof | 高丽大学校产学协力团 | 2024-11-15 | — | — | CN | disclosed |
| WO-2023191536-A1 | THIOBENZIMIDAZOLE DERIVATIVE OR PHARMACEUTICALLY ACCEPTABLE SALT THEREOF, AND USE THEREOF | 고려대학교 산학협력단 | 2023-10-05 | — | — | WO | disclosed |