Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOB | P27338 | 2/20 | 0.40 |
| ▸ | CALM1 | P0DP23 | 1/20 | 0.38 |
| ▸ | G6PC1 | P35575 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.35 |
| ▸ | TSHR | P16473 | 4/20 | 0.35 |
| ▸ | TRPA1 | O75762 | 2/20 | 0.35 |
| ▸ | IDO1 | P14902 | 1/20 | 0.35 |
| ▸ | TP53 | P04637 | 1/20 | 0.35 |
| ▸ | LOXL2 | Q9Y4K0 | 1/20 | 0.35 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 2/20 | 0.34 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.33 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.33 |
| ▸ | CASP1 | P29466 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL1195145 | 1.00 | MAOB (0.40) | MAOBCALM1G6PC1CYP3A4CYP2C9 | |
| SCHEMBL7380364 | 0.81 | CYP11B2 (0.47) | G6PC1CYP3A4CYP2C9LMNAMAPK1 | |
| SCHEMBL8673921 | 0.77 | ALDH1A1 (0.41) | MAOBALDH1A1TRPA1LOXL2CYP2A6 | |
| SCHEMBL4340782 | 0.77 | MAOB (0.36) | MAOBCALM1G6PC1CYP3A4CYP2C9 | |
| SCHEMBL5573317 | 0.77 | MAOB (0.43) | MAOBCALM1CYP3A4ALDH1A1TSHR | |
| SCHEMBL6608385 | 0.73 | TSHR (0.42) | MAOBCALM1CYP3A4ALDH1A1TSHR | |
| SCHEMBL1509680 | 0.73 | MAOB (0.42) | MAOBALDH1A1TSHRTRPA1TP53 | |
| SCHEMBL3808266 | 0.73 | MAOB (0.42) | MAOBCYP3A4CYP2C9ALDH1A1TSHR | |
| SCHEMBL8863221 | 0.73 | MAOB (0.42) | MAOBCYP2C9ALDH1A1TSHRTRPA1 | |
| SCHEMBL5083636 | 0.73 | MAOB (0.42) | MAOBALDH1A1TSHRTRPA1TP53 |
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-0441226-A1 | (cyanomethyl)pyridines useful as PAF antagonists | J. URIACH & CIA. S.A. (ES) | 1991-08-14 | — | — | EP | disclosed |