Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | SLC18A3 | Q16572 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | VCP | P55072 | 1/20 | 0.32 |
| ▸ | ADAMTS5 | Q9UNA0 | 2/20 | 0.32 |
| ▸ | MMP2 | P08253 | 1/20 | 0.32 |
| ▸ | MMP13 | P45452 | 1/20 | 0.32 |
| ▸ | ADAM17 | P78536 | 1/20 | 0.32 |
| ▸ | CASP3 | P42574 | 1/20 | 0.32 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.32 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | GAA | P10253 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | SLC5A2 | P31639 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL6962492 | 0.93 | TLR8 (0.33) | ALDH1A1MEN1CYP1A2CYP2C9CYP2C19 | |
| SCHEMBL6972834 | 0.92 | TLR8 (0.35) | ALDH1A1MEN1CYP1A2CYP2C9CYP2C19 | |
| SCHEMBL6968770 | 0.87 | TDP1 (0.35) | MEN1KMT2ATDP1VCPADAMTS5 | |
| SCHEMBL8109133 | 0.87 | VCP (0.35) | TDP1VCPADAMTS5MMP2MMP13 | |
| SCHEMBL14439831 | 0.85 | HDAC1 (0.40) | TDP1VCPADAMTS5MMP2MMP13 | |
| SCHEMBL6972409 | 0.85 | VCP (0.35) | TDP1VCPMAPTSLC5A2RECQL | |
| SCHEMBL14439829 | 0.85 | VCP (0.36) | TDP1VCPADAMTS5MMP2MMP13 | |
| SCHEMBL14439828 | 0.85 | TDP1 (0.40) | KMT2ATDP1VCPMAPTSLC5A2 | |
| SCHEMBL6972304 | 0.84 | HSP90B1 (0.37) | ALDH1A1MEN1KMT2ATDP1VCP | |
| SCHEMBL6966496 | 0.84 | VCP (0.37) | TDP1VCPADAMTS5MMP2MMP13 |
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-0786455-B1 | IMIDAZOLE DERIVATIVE | SHIONOGI & CO (JP) | 2003-12-03 | — | — | EP | disclosed |
| US-6147097-A | METHOD FOR TREATING AIDS | SHIONOGI & CO., LTD. (JP) | 2000-11-14 | — | — | US | disclosed |