Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 3/20 | 0.41 |
| ▸ | CYP2A6 | P11509 | 3/20 | 0.41 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.38 |
| ▸ | SCN5A | Q14524 | 2/20 | 0.34 |
| ▸ | SCN9A | Q15858 | 2/20 | 0.34 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.34 |
| ▸ | NR4A2 | P43354 | 1/20 | 0.34 |
| ▸ | LTA4H | P09960 | 1/20 | 0.32 |
| ▸ | GRM5 | P41594 | 1/20 | 0.32 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | PNMT | P11086 | 1/20 | 0.31 |
| ▸ | NPC1 | O15118 | 1/20 | 0.31 |
| ▸ | RAB9A | P51151 | 1/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.31 |
| ▸ | AR | P10275 | 1/20 | 0.31 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.30 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL6001756 | 0.83 | SLC6A3 (0.41) | SLC6A3SCN5ASCN9APNMTNPC1 | |
| SCHEMBL11065012 | 0.70 | MAPT (0.45) | CYP1A2SLC6A3LTA4HNPC1RAB9A | |
| SCHEMBL11073422 | 0.70 | SLC6A3 (0.40) | CYP1A2SLC6A3LTA4HGRM5ALDH1A1 | |
| SCHEMBL15351192 | 0.68 | CYP1A2 (0.59) | CYP1A2CYP2A6NR4A2PNMT | |
| SCHEMBL2793555 | 0.68 | GPR84 (0.59) | CYP1A2CYP2A6ALDH1A1RAB9A | |
| SCHEMBL15352644 | 0.66 | CYP1A2 (0.62) | CYP1A2CYP2A6NR4A2HSP90AA1PNMT | |
| SCHEMBL11865918 | 0.66 | CYP1A2 (0.62) | CYP1A2CYP2A6NR4A2PNMT | |
| SCHEMBL15345384 | 0.64 | PNMT (0.64) | CYP1A2CYP2A6NR4A2PNMT | |
| SCHEMBL12770134 | 0.64 | CYP1A2 (0.59) | CYP1A2CYP2A6NR4A2ALDH1A1PNMT | |
| SCHEMBL7840004 | 0.64 | CYP1A2 (0.59) | CYP1A2CYP2A6NR4A2PNMTNPC1 |
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 |
|---|---|---|---|---|---|---|---|
| US-6951918-B2 | Peptidic procollagen C-proteinase inhibitors | SYNTEX (U.S.A.) LLC (US) | 2005-10-04 | — | — | US | disclosed |
| US-6426402-B1 | RESPIRATORY SYSTEM DISORDERS; RHEUMATIC DISEASES | SYNTEX (U.S.A.) LLC | 2002-07-30 | — | — | US | disclosed |