Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LMNA | P02545 | 4/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | CHRM2 | P08172 | 2/20 | 0.36 |
| ▸ | CHRM1 | P11229 | 2/20 | 0.36 |
| ▸ | CHRM3 | P20309 | 2/20 | 0.36 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.36 |
| ▸ | CCR1 | P32246 | 1/20 | 0.36 |
| ▸ | OPRM1 | P35372 | 2/20 | 0.36 |
| ▸ | OPRD1 | P41143 | 2/20 | 0.36 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.36 |
| ▸ | OPRL1 | P41146 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 2/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | ACE2 | Q9BYF1 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.35 |
| ▸ | ROCK2 | O75116 | 2/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL27675975 | 0.96 | NPSR1 (0.40) | LMNANPSR1HPGDCHRM2CHRM1 | |
| SCHEMBL4624849 | 0.88 | SLC6A2 (0.41) | LMNANPSR1HPGDCHRM2CHRM1 | |
| SCHEMBL27681435 | 0.87 | SLC6A2 (0.43) | LMNAHPGDCCR1ALDH1A1MEN1 | |
| SCHEMBL27661851 | 0.87 | SLC6A2 (0.43) | OPRM1OPRD1OPRK1OPRL1NPC1 | |
| SCHEMBL5695482 | 0.85 | ALDH1A1 (0.39) | LMNANPSR1HPGDCHRM2CHRM1 | |
| SCHEMBL27681429 | 0.83 | SLC6A2 (0.39) | LMNAHPGDALDH1A1SMN1; SMN2 | |
| SCHEMBL3955198 | 0.82 | ESRRB (0.44) | LMNAALDH1A1MEN1MAPTKMT2A | |
| SCHEMBL27655996 | 0.81 | ALDH1A1 (0.40) | LMNANPSR1HPGDCHRM3ALDH1A1 | |
| SCHEMBL27662478 | 0.81 | SLC6A2 (0.49) | — | |
| SCHEMBL27656082 | 0.80 | LMNA (0.41) | LMNANPSR1HPGDCHRM2CHRM1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-1972920-A | Arylalkyl piperazine derivatives for the treatment of conditions ameliorated by monoamine reuptake including vasomotor symptoms | WYETH CORP (US) | 2007-05-30 | — | — | CN | disclosed |
| CN-1894226-A | Arylalkyl- and cycloalkylalkyl-piperazine derivatives and methods of their use | WYETH CORP (US) | 2007-01-10 | — | — | CN | disclosed |