Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.38 |
| ▸ | OPRD1 | P41143 | 7/20 | 0.35 |
| ▸ | OPRM1 | P35372 | 5/20 | 0.35 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.35 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.35 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.35 |
| ▸ | SIGMAR1 | Q99720 | 3/20 | 0.34 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.33 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL7953553 | 0.98 | ALDH1A1 (0.37) | ALDH1A1LMNAMAPTHPGDRAB9A | |
| SCHEMBL1652270 | 0.84 | OPRD1 (0.37) | OPRD1OPRM1SLC6A2SLC6A4SLC6A3 | |
| Hydrochloric Acid SCHEMBL27387046 | 0.83 | OPRD1 (0.36) | OPRD1OPRM1SLC6A2SLC6A4SLC6A3 | |
| SCHEMBL27387610 | 0.83 | OPRD1 (0.36) | OPRD1OPRM1SLC6A2SLC6A4SLC6A3 | |
| SCHEMBL27461888 | 0.82 | ALDH1A1 (0.40) | ALDH1A1LMNAMAPTHPGDRAB9A | |
| Potassium Ion SCHEMBL6704617 | 0.81 | SIGMAR1 (0.33) | OPRD1OPRM1SLC6A2SLC6A4SLC6A3 | |
| SCHEMBL1408748 | 0.80 | ALDH1A1 (0.41) | ALDH1A1LMNAMAPTHPGDRAB9A | |
| SCHEMBL2110264 | 0.79 | SIGMAR1 (0.42) | ALDH1A1LMNAMAPTHPGDRAB9A | |
| SCHEMBL6422237 | 0.77 | SIGMAR1 (0.40) | ALDH1A1LMNAMAPTHPGDRAB9A | |
| Hydrochloric Acid SCHEMBL7970534 | 0.77 | SIGMAR1 (0.41) | ALDH1A1LMNAMAPTHPGDRAB9A |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-1072661-C | Novel substituted [2-(1-piperazinyl) ethoxy] methyl | UCB SA (BE) | 2001-10-10 | — | — | CN | claimed |
| CN-1215395-A | Novel substituted [2-(1-piperazinyl) ethoxy] methyl | UCB SA (BE) | 1999-04-28 | — | — | CN | claimed |
| CN-1134423-A | Adhesion receptor antagonists | MERCK PATENT GMBH (DE) | 1996-10-30 | — | — | CN | disclosed |