Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 3/20 | 0.35 |
| ▸ | MEN1 | O00255 | 2/20 | 0.35 |
| ▸ | TSHR | P16473 | 2/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.33 |
| ▸ | CYP19A1 | P11511 | 2/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | KLKB1 | P03952 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.33 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.33 |
| ▸ | TP53 | P04637 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | P2RX3 | P56373 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL7082609 | 0.89 | IDO1 (0.38) | KMT2AALDH1A1TDP1KDM4EPTGDR2 | |
| SCHEMBL6975519 | 0.89 | ALDH1A1 (0.41) | ALDH1A1TDP1SMN1; SMN2KDM4EPTGDR2 | |
| SCHEMBL6963163 | 0.88 | GRIN1 (0.36) | KMT2AMEN1CYP1A2CYP2C9CYP2C19 | |
| SCHEMBL6973011 | 0.88 | MEN1 (0.34) | KMT2AMEN1ALDH1A1CYP19A1TDP1 | |
| SCHEMBL6964793 | 0.87 | MEN1 (0.33) | KMT2AMEN1ALDH1A1CYP19A1SMN1; SMN2 | |
| SCHEMBL6973925 | 0.85 | PDE4A (0.37) | KMT2AMEN1CYP2C9CYP2C19ALDH1A1 | |
| SCHEMBL6960619 | 0.85 | MEN1 (0.37) | KMT2AMEN1TSHRCYP1A2CYP2C9 | |
| SCHEMBL7084768 | 0.84 | PTGDR2 (0.36) | KMT2AMEN1TSHRCYP1A2CYP2C9 | |
| SCHEMBL6975584 | 0.84 | TDP1 (0.34) | KMT2AMEN1TSHRCYP1A2CYP2C9 | |
| SCHEMBL6975053 | 0.84 | MEN1 (0.41) | KMT2AMEN1TSHRCYP1A2CYP2C9 |
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 4 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 |
| 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 |
| EP-0786455-A1 | IMIDAZOLE DERIVATIVE | SHIONOGI & CO., LTD. (JP) | 1997-07-30 | — | — | EP | disclosed |