Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ANPEP | P15144 | 2/20 | 0.47 |
| ▸ | ERAP1 | Q9NZ08 | 2/20 | 0.47 |
| ▸ | ERAP2 | Q6P179 | 1/20 | 0.47 |
| ▸ | TAAR1 | Q96RJ0 | 2/20 | 0.43 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.43 |
| ▸ | HTR2A | P28223 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | LOXL2 | Q9Y4K0 | 1/20 | 0.43 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.41 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | MAOA | P21397 | 2/20 | 0.40 |
| ▸ | MAOB | P27338 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.39 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.39 |
| ▸ | CASP1 | P29466 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL5324322 | 0.80 | CYP1A2 (0.47) | TAAR1CYP2A6CYP2D6NFKB1LMNA | |
| SCHEMBL5774965 | 0.79 | CTSC (0.48) | ANPEPERAP1ERAP2TAAR1CYP2A6 | |
| SCHEMBL7730597 | 0.79 | ANPEP (0.52) | ANPEPERAP1ERAP2TAAR1CYP2A6 | |
| SCHEMBL3391047 | 0.79 | ANPEP (0.52) | ANPEPERAP1ERAP2TAAR1CYP2A6 | |
| SCHEMBL1029065 | 0.79 | ANPEP (0.52) | ANPEPERAP1ERAP2TAAR1CYP2A6 | |
| SCHEMBL5758862 | 0.79 | CTSC (0.48) | ANPEPERAP1ERAP2TAAR1CYP2A6 | |
| SCHEMBL4950698 | 0.78 | EPHX1 (0.56) | ANPEPTAAR1CYP2A6EPHX1CYP2D6 | |
| SCHEMBL4730309 | 0.78 | EPHX1 (0.56) | ANPEPTAAR1CYP2A6EPHX1CYP2D6 | |
| Hydrochloric Acid SCHEMBL3870394 | 0.78 | CTSC (0.47) | ANPEPERAP1ERAP2TAAR1CYP2A6 | |
| Hydrochloric Acid SCHEMBL2915867 | 0.78 | CTSC (0.47) | ANPEPERAP1ERAP2TAAR1CYP2A6 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0233229-B1 | PREPARATION OF AN ALLYL AMINE AND QUATERNARY DIALLYL AMMONIUM COMPOUNDS THEREFROM | THE DOW CHEMICAL COMPANY (US) | 1990-06-13 | — | — | EP | disclosed |