Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTPN1 | P18031 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL2502936 | 1.00 | PTPN1 (0.33) | PTPN1CYP1A2CYP2A6 | |
| SCHEMBL2214684 | 0.84 | TSHR (0.39) | — | |
| SCHEMBL2494317 | 0.83 | GAA (0.31) | — | |
| SCHEMBL64412 | 0.81 | ALDH1A1 (0.34) | CYP1A2CYP2A6 | |
| SCHEMBL5227738 | 0.79 | CYP1A2 (0.40) | CYP1A2CYP2A6 | |
| SCHEMBL64917 | 0.79 | CYP1A2 (0.40) | CYP1A2CYP2A6 | |
| SCHEMBL1389283 | 0.79 | TLR8 (0.37) | — | |
| SCHEMBL2459600 | 0.78 | — | — | |
| SCHEMBL2256189 | 0.77 | L3MBTL1 (0.41) | CYP1A2 | |
| SCHEMBL1396371 | 0.76 | LTA4H (0.41) | CYP1A2 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1268584-A4 | COMPOSITIONS AND METHODS FOR SELECTIVELY BINDING AMINES OR AMINO ACID ENANTIOMERS OVER THEIR COUNTER-ENANTIOMERS | IBC ADVANCED TECH INC (US) | 2003-06-18 | — | — | EP | disclosed |
| EP-1268584-A1 | COMPOSITIONS AND METHODS FOR SELECTIVELY BINDING AMINES OR AMINO ACID ENANTIOMERS OVER THEIR COUNTER-ENANTIOMERS | IBC ADVANCED TECHNOLOGIES, INC. (US) | 2003-01-02 | — | — | EP | disclosed |
| WO-2001068729-A1 | COMPOSITIONS AND METHODS FOR SELECTIVELY BINDING AMINES OR AMINO ACID ENANTIOMERS OVER THEIR COUNTER-ENANTIOMERS | IBC ADVANCED TECHNOLOGIES, INC. (US) | 2001-09-20 | — | — | WO | disclosed |