Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTPRA | P18433 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | GRIN2D | O15399 | 1/20 | 0.35 |
| ▸ | GRIN3B | O60391 | 1/20 | 0.35 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.35 |
| ▸ | GRIN2A | Q12879 | 1/20 | 0.35 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.35 |
| ▸ | GRIN2C | Q14957 | 1/20 | 0.35 |
| ▸ | GRIN3A | Q8TCU5 | 1/20 | 0.35 |
| ▸ | DHFR | P00374 | 1/20 | 0.34 |
| ▸ | FDPS | P14324 | 1/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 5/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.33 |
| ▸ | TSHR | P16473 | 2/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.33 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.32 |
| ▸ | FNTA | P49354 | 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 | |
|---|---|---|---|---|
| SCHEMBL7081552 | 0.89 | PTPRA (0.34) | PTPRAKDM4EFDPSCYP1A2CYP2D6 | |
| SCHEMBL6967986 | 0.89 | SLC6A9 (0.34) | PTPRAKDM4EGRIN1GRIN2BFDPS | |
| SCHEMBL7079932 | 0.89 | GRM5 (0.38) | PTPRAKDM4ECYP1A2MAPTSMN1; SMN2 | |
| SCHEMBL6973516 | 0.88 | PTPRA (0.33) | PTPRAKDM4EFDPSCYP1A2ALDH1A1 | |
| SCHEMBL6976955 | 0.88 | RHEB (0.34) | PTPRAKDM4EFDPSCYP1A2MAPT | |
| SCHEMBL6972933 | 0.85 | CYP1A2 (0.39) | KDM4ECYP1A2MAPTSMN1; SMN2ALDH1A1 | |
| SCHEMBL7078351 | 0.84 | SLC6A4 (0.36) | DHFRCYP1A2CYP2D6ALDH1A1CYP2C19 | |
| SCHEMBL7084495 | 0.82 | PTPRA (0.37) | PTPRADHFRFDPSCYP1A2CYP2D6 | |
| SCHEMBL6974559 | 0.82 | PTPRA (0.32) | PTPRAGRIN2DGRIN3BGRIN1GRIN2A | |
| SCHEMBL7081802 | 0.82 | DHFR (0.39) | KDM4EDHFRSLC6A4KMT2A |
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 |