Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GPR3 | P46089 | 1/20 | 0.64 |
| ▸ | CA2 | P00918 | 2/20 | 0.59 |
| ▸ | CA12 | O43570 | 1/20 | 0.59 |
| ▸ | CA1 | P00915 | 1/20 | 0.59 |
| ▸ | CA4 | P22748 | 1/20 | 0.59 |
| ▸ | CA7 | P43166 | 1/20 | 0.59 |
| ▸ | CA9 | Q16790 | 1/20 | 0.59 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.59 |
| ▸ | MAPT | P10636 | 4/20 | 0.53 |
| ▸ | RAB9A | P51151 | 4/20 | 0.53 |
| ▸ | NPC1 | O15118 | 3/20 | 0.53 |
| ▸ | HPGD | P15428 | 2/20 | 0.53 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.53 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.53 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.53 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.53 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.49 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| Dibenzothiophene SCHEMBL29220086 | 1.00 | GPR3 (0.64) | GPR3CA2CA12CA1CA4 | |
| Dibenzothiophene SCHEMBL29220084 | 0.86 | GPR3 (0.52) | GPR3CA2CA12CA1CA4 | |
| Dibenzothiophene SCHEMBL30901469 | 0.86 | GPR3 (0.52) | GPR3CA2CA12CA1CA4 | |
| SCHEMBL3295801 | 0.84 | GPR3 (0.48) | GPR3CA2CA12CA1CA4 | |
| SCHEMBL25613275 | 0.84 | NPC1 (0.55) | GPR3CA2CA12CA1CA4 | |
| Dibenzothiophene SCHEMBL29220085 | 0.80 | GPR3 (0.61) | GPR3CA4MAPTRAB9ANPC1 | |
| Dibenzothiophene SCHEMBL14659543 | 0.80 | GPR3 (1.00) | GPR3CA12CA9MAPTRAB9A | |
| Dibenzothiophene SCHEMBL30167635 | 0.80 | GPR3 (1.00) | GPR3CA12CA9MAPTRAB9A | |
| Dibenzothiophene SCHEMBL13294 | 0.80 | GPR3 (1.00) | GPR3CA12CA9MAPTRAB9A | |
| SCHEMBL30925001 | 0.78 | NPC1 (0.70) | MAPTRAB9ANPC1HPGDCYP1A2 |
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 |
|---|---|---|---|---|---|---|---|
| CN-118108641-A | Synthesis method of arylsulfonyl derivative | 淮北师范大学 | 2024-05-31 | — | — | CN | disclosed |