Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRM2 | P08172 | 2/20 | 0.48 |
| ▸ | HTR1A | P08908 | 2/20 | 0.48 |
| ▸ | CHRM1 | P11229 | 2/20 | 0.48 |
| ▸ | OPRM1 | P35372 | 2/20 | 0.48 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.48 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.48 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.48 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.48 |
| ▸ | DRD1 | P21728 | 1/20 | 0.48 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.48 |
| ▸ | ACHE | P22303 | 1/20 | 0.48 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.48 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.48 |
| ▸ | DRD3 | P35462 | 1/20 | 0.48 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.48 |
| ▸ | CCR2 | P41597 | 1/20 | 0.46 |
| ▸ | HTT | P42858 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.45 |
| ▸ | MEN1 | O00255 | 2/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL11485688 | 0.99 | CHRM2 (0.50) | CHRM2HTR1ACHRM1OPRM1KCNH2 | |
| SCHEMBL11494176 | 0.99 | CHRM2 (0.50) | CHRM2HTR1ACHRM1OPRM1KCNH2 | |
| SCHEMBL11496128 | 0.90 | CHRM2 (0.49) | CHRM2HTR1ACHRM1OPRM1KCNH2 | |
| SCHEMBL11487415 | 0.90 | HTT (0.58) | CHRM2CHRM1SLC6A4SLC6A3CCR2 | |
| SCHEMBL11486298 | 0.89 | ALDH1A1 (0.47) | SLC6A4SLC6A3CCR2HTTALDH1A1 | |
| SCHEMBL11493698 | 0.89 | ALDH1A1 (0.44) | CHRM2CHRM1SLC6A4SLC6A3HRH3 | |
| SCHEMBL11492517 | 0.89 | HTT (0.47) | SLC6A4SLC6A3CCR2HTTALDH1A1 | |
| SCHEMBL11492547 | 0.87 | ALDH1A1 (0.60) | HTR1AKCNH2ALDH1A1MEN1KMT2A | |
| SCHEMBL11487323 | 0.87 | LTA4H (0.56) | CHRM2HTR1ACHRM1OPRM1KCNH2 | |
| SCHEMBL11489480 | 0.87 | CYP2D6 (0.56) | CHRM2HTR1ACHRM1OPRM1KCNH2 |
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-4239759-A | Morpholino containing compounds, compositions and use thereof | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 1980-12-16 | — | — | US | disclosed |
| US-4110447-A | Anti-inflammatory (halo-4-biphenylyl)-alkanolamines | MERCK PATENT GESELLSCHAFT MIT BESCHRAENKTER HAFTUNG (DE) | 1978-08-29 | — | — | US | disclosed |