Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | FFAR1 | O14842 | 1/20 | 0.39 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.38 |
| ▸ | LMNA | P02545 | 2/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | HPGD | P15428 | 2/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.37 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.37 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.37 |
| ▸ | IRAK4 | Q9NWZ3 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 2/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.36 |
| ▸ | PKM | P14618 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | RECQL | P46063 | 1/20 | 0.35 |
| ▸ | PDE5A | O76074 | 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 | |
|---|---|---|---|---|
| SCHEMBL8345494 | 1.00 | FFAR1 (0.39) | FFAR1HDAC6LMNAALDH1A1HPGD | |
| SCHEMBL6961860 | 0.90 | MEN1 (0.42) | LMNAALDH1A1SMN1; SMN2HSP90AA1IRAK4 | |
| SCHEMBL6964269 | 0.89 | HSP90AA1 (0.39) | LMNAALDH1A1HPGDSMN1; SMN2HSP90AA1 | |
| SCHEMBL6971341 | 0.89 | CYP2C9 (0.38) | FFAR1LMNAALDH1A1HPGDSMN1; SMN2 | |
| SCHEMBL6971348 | 0.89 | CYP2C9 (0.38) | FFAR1LMNAALDH1A1HPGDSMN1; SMN2 | |
| SCHEMBL6972247 | 0.87 | HSP90AA1 (0.38) | LMNAALDH1A1HPGDSMN1; SMN2HSP90AA1 | |
| SCHEMBL7078920 | 0.87 | ALDH1A1 (0.41) | LMNAALDH1A1HPGDSMN1; SMN2HSP90AA1 | |
| SCHEMBL6966439 | 0.87 | HSP90AA1 (0.41) | LMNAALDH1A1HPGDSMN1; SMN2HSP90AA1 | |
| SCHEMBL6971525 | 0.86 | NPC1 (0.36) | LMNAALDH1A1HPGDSMN1; SMN2HSP90AA1 | |
| SCHEMBL7080662 | 0.85 | LMNA (0.36) | LMNAALDH1A1HPGDSMN1; SMN2HSP90AA1 |
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 |
|---|---|---|---|---|---|---|---|
| US-5910506-A | IMIDAZOLE DERIVATIVES, E.G.5-(3,5-DICHLOROPHENYLTHIO)-1,2-DIMETHYL-4-ISOPROPYL-1H-IMIDAZOLE; VIRICIDES; AIDS; NONTOXIC | SHIONOGI & CO., LTD. (JP) | 1999-06-08 | — | — | US | disclosed |