Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2D6 | P10635 | 5/20 | 0.58 |
| ▸ | KCNH2 | Q12809 | 6/20 | 0.58 |
| ▸ | GRIN2D | O15399 | 1/20 | 0.58 |
| ▸ | GRIN3B | O60391 | 1/20 | 0.58 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.58 |
| ▸ | GRIN2A | Q12879 | 1/20 | 0.58 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.58 |
| ▸ | GRIN2C | Q14957 | 1/20 | 0.58 |
| ▸ | GRIN3A | Q8TCU5 | 1/20 | 0.58 |
| ▸ | OPRM1 | P35372 | 3/20 | 0.50 |
| ▸ | OPRD1 | P41143 | 3/20 | 0.50 |
| ▸ | OPRK1 | P41145 | 3/20 | 0.50 |
| ▸ | OPRL1 | P41146 | 3/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL7948746 | 1.00 | CYP2D6 (0.58) | CYP2D6KCNH2GRIN2DGRIN3BGRIN1 | |
| SCHEMBL8057978 | 0.94 | CYP2D6 (0.53) | CYP2D6KCNH2GRIN2DGRIN3BGRIN1 | |
| SCHEMBL8057976 | 0.94 | CYP2D6 (0.53) | CYP2D6KCNH2GRIN2DGRIN3BGRIN1 | |
| SCHEMBL6959404 | 0.89 | CYP2D6 (0.65) | CYP2D6KCNH2GRIN2DGRIN3BGRIN1 | |
| SCHEMBL6959401 | 0.89 | CYP2D6 (0.65) | CYP2D6KCNH2GRIN2DGRIN3BGRIN1 | |
| SCHEMBL8714090 | 0.89 | CYP2D6 (0.65) | CYP2D6KCNH2GRIN2DGRIN3BGRIN1 | |
| SCHEMBL8812627 | 0.89 | CYP2D6 (0.73) | CYP2D6KCNH2GRIN2DGRIN3BGRIN1 | |
| SCHEMBL6816805 | 0.89 | CYP2D6 (0.73) | CYP2D6KCNH2GRIN2DGRIN3BGRIN1 | |
| SCHEMBL6962719 | 0.88 | CYP2D6 (0.69) | CYP2D6KCNH2GRIN2DGRIN3BGRIN1 | |
| SCHEMBL8810285 | 0.88 | CYP2D6 (0.69) | CYP2D6KCNH2GRIN2DGRIN3BGRIN1 |
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-6258827-B1 | HYDROXYAROMATIC HETEROCYCLIC ALKANOLS AND LEVODOPA | PFIZER INC. | 2001-07-10 | — | — | US | disclosed |
| US-6046213-A | Neuroprotective 3-(piperidinyl-1)-chroman-4,7-diol and 1-(4-hydroxyphenyl)-2-(piperidinyl-1)-alkanol derivatives | PFIZER INC. (US) | 2000-04-04 | — | — | US | disclosed |