Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 2/20 | 0.37 |
| ▸ | CA2 | P00918 | 2/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.37 |
| ▸ | ATM | Q13315 | 1/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.37 |
| ▸ | PGK1 | P00558 | 2/20 | 0.32 |
| ▸ | PGK2 | P07205 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL17092743 | 0.82 | CA1 (0.38) | CA1CA2TSHRMAPK1ATM | |
| SCHEMBL5655554 | 0.79 | TSHR (0.46) | CA1CA2TSHRMAPK1ATM | |
| SCHEMBL9798184 | 0.76 | CA1 (0.41) | CA1CA2TSHRMAPK1ATM | |
| SCHEMBL11698176 | 0.75 | CA1 (0.37) | CA1CA2TSHRMAPK1ATM | |
| SCHEMBL19417918 | 0.75 | CA1 (0.41) | CA1CA2TSHRMAPK1ATM | |
| SCHEMBL10179845 | 0.75 | TSHR (0.41) | CA1CA2TSHRMAPK1ATM | |
| SCHEMBL4574471 | 0.75 | TSHR (0.41) | CA1CA2TSHRMAPK1ATM | |
| SCHEMBL20560222 | 0.75 | CA1 (0.33) | CA1CA2 | |
| SCHEMBL97582 | 0.74 | CA1 (0.52) | CA1CA2TSHRTDP1 | |
| Hydrochloric Acid SCHEMBL19692755 | 0.73 | LOXL2 (0.33) | CA1CA2TDP1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1138657-A1 | Process for generating electrophiles from anions by reaction with electrophilic fluorinating agent | AIR PRODUCTS AND CHEMICALS, INC. (US) | 2001-10-04 | — | — | EP | disclosed |
| US-6270843-B1 | REACTING A SALT COMPRISING ANIONIC FORM OF SUBSTITUENT WITH AN ELECTROPHILIC FLUORINATION AGENT TO PROVIDE AN ELECTROPHILE COMPRISING CATIONIC FORM OF SUBSTITUENT; ELECTROPHILICALLY SUBSTITUTING ELECTROPHILE ON SUBSTRATE | AIR PRODUCTS AND CHEMICALS, INC. | 2001-08-07 | — | — | US | disclosed |