Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PNMT | P11086 | 2/20 | 0.48 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.44 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.43 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.43 |
| ▸ | IDO1 | P14902 | 2/20 | 0.43 |
| ▸ | ADA | P00813 | 1/20 | 0.43 |
| ▸ | SLC6A2 | P23975 | 3/20 | 0.41 |
| ▸ | SLC6A4 | P31645 | 3/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.41 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.40 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | GLA | P06280 | 1/20 | 0.40 |
| ▸ | P2RX7 | Q99572 | 2/20 | 0.39 |
| ▸ | CXCL8 | P10145 | 1/20 | 0.39 |
| ▸ | PYGL | P06737 | 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 | |
|---|---|---|---|---|
| SCHEMBL16973793 | 0.81 | L3MBTL1 (0.42) | IDO1CYP1A2ALDH1A1LMNA | |
| SCHEMBL30962394 | 0.81 | PNMT (0.50) | PNMTTAAR1GRIN1GRIN2BIDO1 | |
| SCHEMBL18568286 | 0.80 | PNMT (0.44) | PNMTTAAR1GRIN1GRIN2BIDO1 | |
| SCHEMBL11434668 | 0.80 | PNMT (0.44) | PNMTTAAR1GRIN1GRIN2BIDO1 | |
| SCHEMBL8076310 | 0.77 | PNMT (0.48) | PNMTTAAR1IDO1SLC6A2SLC6A4 | |
| SCHEMBL3885817 | 0.77 | PNMT (0.57) | PNMTTAAR1IDO1SLC6A2SLC6A4 | |
| SCHEMBL18567935 | 0.77 | PNMT (0.52) | PNMTTAAR1IDO1SLC6A2SLC6A4 | |
| SCHEMBL13692532 | 0.77 | PNMT (0.57) | PNMTTAAR1IDO1SLC6A2SLC6A4 | |
| SCHEMBL5805934 | 0.77 | PNMT (0.52) | PNMTTAAR1IDO1SLC6A2SLC6A4 | |
| SCHEMBL8803316 | 0.76 | MAOB (0.49) | PNMTCYP3A4P2RX7 |
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-1910272-A1 | RENIN INHIBITORS | Merck Frosst Canada Ltd. (CA) | 2008-04-16 | — | — | EP | claimed |
| WO-2007009250-A1 | RENIN INHIBITORS | MERCK FROSST CANADA LTD. (CA) | 2007-01-25 | — | — | WO | claimed |