Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.48 |
| ▸ | LMNA | P02545 | 2/20 | 0.48 |
| ▸ | MAPT | P10636 | 2/20 | 0.48 |
| ▸ | MEN1 | O00255 | 1/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.48 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.48 |
| ▸ | HPGD | P15428 | 2/20 | 0.48 |
| ▸ | HTT | P42858 | 2/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.47 |
| ▸ | CYP26A1 | O43174 | 1/20 | 0.46 |
| ▸ | ITGB3 | P05106 | 1/20 | 0.46 |
| ▸ | ITGAV | P06756 | 1/20 | 0.46 |
| ▸ | ITGA2B | P08514 | 1/20 | 0.46 |
| ▸ | ITGB5 | P18084 | 1/20 | 0.46 |
| ▸ | ITGB6 | P18564 | 1/20 | 0.46 |
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 SCHEMBL7168369 | 0.99 | ALDH1A1 (0.48) | ALDH1A1KDM4ELMNAMAPTMEN1 | |
| SCHEMBL7365092 | 0.85 | ALDH1A1 (0.50) | ALDH1A1KDM4ELMNAMAPTMEN1 | |
| Hydrochloric Acid SCHEMBL7172679 | 0.84 | ALDH1A1 (0.49) | ALDH1A1KDM4ELMNAMAPTMEN1 | |
| SCHEMBL10265619 | 0.84 | ALDH1A1 (0.53) | ALDH1A1KDM4ELMNAMAPTMEN1 | |
| SCHEMBL665809 | 0.82 | CYP26A1 (0.49) | ALDH1A1KDM4ELMNAMAPTMEN1 | |
| SCHEMBL24036727 | 0.81 | KCNA5 (0.47) | ALDH1A1MAPTMEN1KMT2AHTT | |
| SCHEMBL24036731 | 0.81 | WDR5 (0.50) | ALDH1A1MEN1KMT2AHPGD | |
| SCHEMBL24036950 | 0.81 | TACR3 (0.39) | MAPTMEN1KMT2AL3MBTL1SMN1; SMN2 | |
| SCHEMBL665345 | 0.80 | MEN1 (0.51) | ALDH1A1LMNAMAPTMEN1KMT2A | |
| SCHEMBL8297473 | 0.80 | MEN1 (0.51) | ALDH1A1LMNAMAPTMEN1KMT2A |
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 |
|---|---|---|---|---|---|---|---|
| EP-1153014-A2 | BETA-ALANINE DERIVATIVES | MERCK PATENT GmbH (DE) | 2001-11-14 | — | — | EP | disclosed |
| WO-2000048996-A2 | β-ALANINE DERIVATIVES | MERCK PATENT GMBH (DE) | 2000-08-24 | — | — | WO | disclosed |