Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.45 |
| ▸ | TP53 | P04637 | 1/20 | 0.45 |
| ▸ | TSHR | P16473 | 1/20 | 0.45 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.42 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.42 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.42 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.42 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.42 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.42 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | HRH2 | P25021 | 1/20 | 0.36 |
| ▸ | HRH1 | P35367 | 1/20 | 0.36 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | BAX | Q07812 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL11496495 | 0.89 | ALDH1A1 (0.47) | ALDH1A1TP53TSHRSLC6A4SLC6A3 | |
| SCHEMBL11489481 | 0.88 | ALDH1A1 (0.49) | ALDH1A1TP53TSHRSLC6A4SLC6A3 | |
| SCHEMBL11492202 | 0.87 | CHRM2 (0.52) | ALDH1A1SLC6A4SLC6A3CHRM2CHRM4 | |
| SCHEMBL11489040 | 0.87 | LMNA (0.47) | ALDH1A1TP53TSHRSLC6A4SLC6A3 | |
| SCHEMBL11485901 | 0.87 | LMNA (0.47) | ALDH1A1TP53TSHRSLC6A4SLC6A3 | |
| SCHEMBL11493906 | 0.86 | ALDH1A1 (0.38) | ALDH1A1TP53TSHRSLC6A4SLC6A3 | |
| SCHEMBL11487165 | 0.86 | SLC6A4 (0.52) | ALDH1A1SLC6A4SLC6A3CHRM2CHRM4 | |
| SCHEMBL11493698 | 0.86 | ALDH1A1 (0.44) | ALDH1A1TSHRSLC6A4SLC6A3CHRM2 | |
| SCHEMBL11486569 | 0.85 | ALDH1A1 (0.63) | ALDH1A1TP53TSHRMEN1MAPT | |
| SCHEMBL11486963 | 0.84 | TP53 (0.49) | ALDH1A1TP53TSHRSLC6A4SLC6A3 |
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 |