Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.50 |
| ▸ | USP2 | O75604 | 1/20 | 0.32 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| Dimethylformamide SCHEMBL28114375 | 0.78 | TSHR (0.50) | TSHR | |
| Trifluoroethanol SCHEMBL7616761 | 0.76 | — | — | |
| Dimethylformamide SCHEMBL28269265 | 0.76 | TSHR (0.64) | TSHRUSP2ALOX15 | |
| Dimethylformamide SCHEMBL849515 | 0.76 | — | — | |
| Dimethylformamide SCHEMBL1835955 | 0.76 | — | — | |
| Dimethylformamide SCHEMBL2678657 | 0.73 | TSHR (0.60) | TSHRUSP2ALOX15 | |
| Dimethylformamide SCHEMBL11302637 | 0.73 | — | — | |
| Dimethylformamide SCHEMBL3457497 | 0.73 | — | — | |
| Dimethylformamide SCHEMBL28317966 | 0.73 | TSHR (0.60) | TSHRUSP2ALOX15 | |
| Trifluoroacetic Acid SCHEMBL7657198 | 0.72 | TSHR (0.50) | TSHR |
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-106661014-A | Azole benzene derivative and crystal thereof | 帝人制药株式会社 | 2017-05-10 | — | — | CN | disclosed |
| US-5505931-A | ISOTHIOCYANATE CONTAINING ANHYDRIDE COMPOUNDS; USEFUL FOR CONTROLLED RELEASE OF NUCLEOPHILIC GROUP OF DIAGNOSTIC OR THERAPEUTIC AGENT | THE DOW CHEMICAL COMPANY (US) | 1996-04-09 | — | — | US | disclosed |
| EP-0687261-A1 | ACID CLEAVABLE COMPOUNDS, THEIR PREPARATION AND USE AS BIFUNCTIONAL ACID-LABILE CROSSLINKING AGENTS | DENDRITECH, INC. (US) | 1995-12-20 | — | — | EP | disclosed |
| WO-1994020487-A1 | ACID CLEAVABLE COMPOUNDS, THEIR PREPARATION AND USE AS BIFUNCTIONAL ACID-LABILE CROSSLINKING AGENTS | THE DOW CHEMICAL COMPANY (US) | 1994-09-15 | — | — | WO | disclosed |