Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 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 | |
|---|---|---|---|---|
| SCHEMBL276808 | 0.68 | — | — | |
| SCHEMBL3164 | 0.68 | — | — | |
| SCHEMBL9285670 | 0.68 | TSHR (0.92) | TSHRALDH1A1TDP1 | |
| Hexane SCHEMBL8845002 | 0.68 | TSHR (0.92) | TSHRALDH1A1TDP1 | |
| Benzene SCHEMBL28552874 | 0.66 | TSHR (0.75) | TSHRALDH1A1TDP1 | |
| Benzene SCHEMBL3206244 | 0.66 | TSHR (0.75) | TSHRALDH1A1TDP1 | |
| Methylene Chloride SCHEMBL25428166 | 0.65 | — | — | |
| SCHEMBL2594659 | 0.65 | — | — | |
| SCHEMBL11596937 | 0.65 | — | — | |
| Fluoride SCHEMBL21873339 | 0.65 | — | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-107641203-B | A3B-type monothioporphyrin compound and its preparation method and use | 山东师范大学 | 2020-09-29 | — | — | CN | disclosed |
| CN-107652445-B | A3B-type monothioporphyrin modified metal organic framework nano material and preparation method and application thereof | 山东师范大学 | 2020-06-30 | — | — | CN | disclosed |
| CN-107652445-A | A kind of A3Porphyrin modified metal organic frame nano material of Type B list sulfydryl and its production and use | 山东师范大学 | 2018-02-02 | — | — | CN | disclosed |
| CN-107641203-A | A kind of A3Type B list sulfydryl porphyrin compound and its production and use | 山东师范大学 | 2018-01-30 | — | — | CN | disclosed |