Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | OPRM1 | P35372 | 8/20 | 0.45 |
| ▸ | OPRD1 | P41143 | 7/20 | 0.45 |
| ▸ | OPRK1 | P41145 | 7/20 | 0.45 |
| ▸ | OPRL1 | P41146 | 7/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.40 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.39 |
| ▸ | GPR55 | Q9Y2T6 | 1/20 | 0.39 |
| ▸ | KCNA5 | P22460 | 1/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.39 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.39 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.39 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.39 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.39 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.39 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.39 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.39 |
| ▸ | DRD1 | P21728 | 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 | |
|---|---|---|---|---|
| SCHEMBL5532770 | 0.82 | ALDH1A1 (0.46) | OPRM1OPRD1OPRK1OPRL1ALDH1A1 | |
| SCHEMBL5507150 | 0.79 | ALDH1A1 (0.44) | OPRM1OPRD1OPRK1OPRL1ALDH1A1 | |
| SCHEMBL1189507 | 0.77 | ALDH1A1 (0.49) | OPRM1OPRD1OPRK1OPRL1ALDH1A1 | |
| SCHEMBL3892551 | 0.76 | ALDH1A1 (0.49) | ALDH1A1KDM4ECYP3A4CYP2D6 | |
| SCHEMBL3887165 | 0.71 | ALDH1A1 (0.46) | OPRM1OPRD1OPRK1OPRL1ALDH1A1 | |
| SCHEMBL2793637 | 0.71 | ALDH1A1 (0.67) | OPRM1OPRD1OPRK1OPRL1ALDH1A1 | |
| SCHEMBL5521172 | 0.71 | ALDH1A1 (0.46) | OPRM1OPRD1OPRK1ALDH1A1KDM4E | |
| SCHEMBL15496992 | 0.69 | LMNA (0.33) | ALDH1A1CYP2D6 | |
| SCHEMBL11989193 | 0.67 | CYP3A4 (0.49) | ALDH1A1CYP3A4HIF1ANPSR1KCNA5 | |
| SCHEMBL12437271 | 0.66 | LMNA (0.41) | ALDH1A1NPSR1 |
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-1745018-A1 | AZETIDINE GLYCINE TRANSPORTER INHIBITORS | Merck & Co., Inc. (US) | 2007-01-24 | — | — | EP | disclosed |
| WO-2005110983-A1 | AZETIDINE GLYCINE TRANSPORTER INHIBITORS | MERCK & CO., INC. (US) | 2005-11-24 | — | — | WO | disclosed |