Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC6 | Q9UBN7 | 3/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | RECQL | P46063 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | RXRA | P19793 | 10/20 | 0.34 |
| ▸ | RXRB | P28702 | 10/20 | 0.34 |
| ▸ | RXRG | P48443 | 10/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | PKM | P14618 | 1/20 | 0.34 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.32 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.31 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.31 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.31 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.31 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.31 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.31 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.31 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.31 |
| ▸ | DGAT1 | O75907 | 1/20 | 0.31 |
| ▸ | GPR17 | Q13304 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL6970756 | 0.89 | HDAC6 (0.41) | HDAC6MEN1RECQLKMT2ARXRA | |
| SCHEMBL6960253 | 0.88 | PTGDR2 (0.32) | — | |
| SCHEMBL6970240 | 0.88 | L3MBTL1 (0.36) | RECQLALDH1A1 | |
| SCHEMBL8345363 | 0.86 | GAA (0.37) | HDAC6RECQLRXRARXRBRXRG | |
| SCHEMBL8347890 | 0.86 | HDAC6 (0.39) | HDAC6MEN1RECQLKMT2ARXRA | |
| SCHEMBL6963069 | 0.85 | HSP90B1 (0.34) | — | |
| SCHEMBL6165079 | 0.85 | HSP90B1 (0.32) | — | |
| SCHEMBL8347989 | 0.84 | HDAC6 (0.50) | HDAC6MEN1RECQLKMT2AALDH1A1 | |
| SCHEMBL6165076 | 0.84 | HSP90B1 (0.32) | — | |
| SCHEMBL6957982 | 0.84 | HSP90B1 (0.31) | — |
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 |