Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTT | P42858 | 1/20 | 0.58 |
| ▸ | TP53 | P04637 | 1/20 | 0.47 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.46 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.44 |
| ▸ | MEN1 | O00255 | 2/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
| ▸ | CHKA | P35790 | 1/20 | 0.43 |
| ▸ | CCR2 | P41597 | 1/20 | 0.43 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.43 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.43 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.43 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.43 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.43 |
| ▸ | CNR1 | P21554 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL11486298 | 0.90 | ALDH1A1 (0.47) | HTTSLC6A4SLC6A3ALDH1A1MEN1 | |
| SCHEMBL11492517 | 0.90 | HTT (0.47) | HTTSLC6A4SLC6A3ALDH1A1MEN1 | |
| SCHEMBL11487389 | 0.90 | CHRM2 (0.48) | HTTSLC6A4SLC6A3ALDH1A1MEN1 | |
| SCHEMBL11485688 | 0.89 | CHRM2 (0.50) | HTTSLC6A4SLC6A3ALDH1A1MEN1 | |
| SCHEMBL11494176 | 0.89 | CHRM2 (0.50) | HTTSLC6A4SLC6A3ALDH1A1MEN1 | |
| SCHEMBL11487560 | 0.88 | HTT (0.55) | HTTTP53SLC6A4SLC6A3ALDH1A1 | |
| SCHEMBL11493698 | 0.87 | ALDH1A1 (0.44) | HTTSLC6A4SLC6A3ALDH1A1MEN1 | |
| SCHEMBL11494398 | 0.87 | SLC6A4 (0.56) | SLC6A4SLC6A3ALDH1A1CHKACHRM2 | |
| SCHEMBL11492547 | 0.86 | ALDH1A1 (0.60) | TP53ALDH1A1MEN1KMT2ASMN1; SMN2 | |
| SCHEMBL11489140 | 0.86 | SLC6A4 (0.56) | HTTSLC6A4SLC6A3ALDH1A1SMN1; SMN2 |
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 |