Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.49 |
| ▸ | TSHR | P16473 | 1/20 | 0.49 |
| ▸ | MAPT | P10636 | 2/20 | 0.45 |
| ▸ | LMNA | P02545 | 2/20 | 0.45 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.45 |
| ▸ | ITGB3 | P05106 | 5/20 | 0.41 |
| ▸ | ITGA2B | P08514 | 5/20 | 0.41 |
| ▸ | HDAC3 | O15379 | 2/20 | 0.40 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.40 |
| ▸ | HDAC10 | Q969S8 | 2/20 | 0.40 |
| ▸ | HDAC11 | Q96DB2 | 2/20 | 0.40 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.40 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.40 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.40 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.40 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.40 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.40 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL28392745 | 0.85 | HDAC3 (0.41) | MAPTLMNANPSR1HDAC3HDAC1 | |
| SCHEMBL28397359 | 0.85 | HDAC3 (0.41) | MAPTLMNANPSR1HDAC3HDAC1 | |
| SCHEMBL3762168 | 0.84 | L3MBTL1 (0.49) | ALDH1A1MAPTLMNA | |
| SCHEMBL8962572 | 0.84 | LMNA (0.40) | ALDH1A1SMN1; SMN2KDM4ETSHRMAPT | |
| SCHEMBL28528392 | 0.78 | ALDH1A1 (0.39) | ALDH1A1SMN1; SMN2KDM4EMAPTLMNA | |
| SCHEMBL21958989 | 0.75 | NAMPT (0.41) | ALDH1A1KDM4ETSHR | |
| SCHEMBL21955680 | 0.75 | ALDH1A1 (0.44) | ALDH1A1SMN1; SMN2 | |
| Adipic Acid SCHEMBL2947633 | 0.72 | HDAC3 (0.42) | ALDH1A1SMN1; SMN2TSHRMAPTLMNA | |
| SCHEMBL29367172 | 0.72 | HDAC3 (0.63) | ALDH1A1SMN1; SMN2TSHRMAPTLMNA | |
| SCHEMBL170857 | 0.72 | LMNA (0.42) | MAPTLMNANPSR1HDAC3HDAC1 |
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-0714832-B1 | Mineral water bottle without off-taste | SCHMALBACH LUBECA (DE) | 1999-05-12 | — | — | EP | disclosed |
| EP-0714832-A1 | Mineral water bottle without off-taste | Schmalbach-Lubeca AG (DE) | 1996-06-05 | — | — | EP | disclosed |