Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.46 |
| ▸ | TLR8 | Q9NR97 | 1/20 | 0.44 |
| ▸ | APLNR | P35414 | 3/20 | 0.44 |
| ▸ | LMNA | P02545 | 3/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | PI4KA | P42356 | 1/20 | 0.38 |
| ▸ | PI4K2B | Q8TCG2 | 1/20 | 0.38 |
| ▸ | PI4K2A | Q9BTU6 | 1/20 | 0.38 |
| ▸ | PI4KB | Q9UBF8 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL6968208 | 0.84 | TLR8 (0.45) | ALDH1A1TLR8APLNRLMNAKDM4E | |
| SCHEMBL7216579 | 0.83 | TLR8 (0.41) | ALDH1A1TLR8APLNRLMNAKDM4E | |
| Hydrochloric Acid SCHEMBL7631242 | 0.82 | HTR2A (0.40) | ALDH1A1TLR8APLNRLMNAKDM4E | |
| SCHEMBL7270020 | 0.81 | ALDH1A1 (0.41) | ALDH1A1TLR8APLNRLMNAKDM4E | |
| SCHEMBL7270215 | 0.78 | AGTR1 (0.47) | ALDH1A1TLR8APLNRLMNAKDM4E | |
| SCHEMBL9530798 | 0.74 | ALDH1A1 (0.41) | ALDH1A1TLR8KMT2AHTR2AHTR2C | |
| SCHEMBL27461046 | 0.74 | ALDH1A1 (0.42) | ALDH1A1TLR8APLNRLMNAMAPK1 | |
| SCHEMBL9452744 | 0.73 | TLR8 (0.42) | ALDH1A1TLR8APLNRLMNAKDM4E | |
| SCHEMBL9422754 | 0.73 | NOTUM (0.44) | ALDH1A1 | |
| SCHEMBL9754909 | 0.73 | TLR8 (0.37) | ALDH1A1TLR8APLNRLMNAKDM4E |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0437103-A2 | Substituted 5-(alkyl)carboxamide imidazoles | SMITHKLINE BEECHAM CORPORATION (US) | 1991-07-17 | — | — | EP | disclosed |