Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | DHODH | Q02127 | 1/20 | 0.33 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.32 |
| ▸ | VCP | P55072 | 1/20 | 0.32 |
| ▸ | CAPN1 | P07384 | 1/20 | 0.32 |
| ▸ | TACR1 | P25103 | 1/20 | 0.31 |
| ▸ | PDE9A | O76083 | 1/20 | 0.31 |
| ▸ | PDE1A | P54750 | 1/20 | 0.31 |
| ▸ | PDE1B | Q01064 | 1/20 | 0.31 |
| ▸ | PDE1C | Q14123 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.30 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL14439826 | 0.88 | TSHR (0.39) | TSHRVCPCAPN1PDE9APDE1A | |
| SCHEMBL5852619 | 0.87 | TACR1 (0.34) | TSHRDHODHVCPCAPN1TACR1 | |
| SCHEMBL6964698 | 0.83 | LMNA (0.36) | TACR1PDE9APDE1APDE1BPDE1C | |
| SCHEMBL5029294 | 0.83 | DHFR (0.41) | ALDH1A1 | |
| SCHEMBL14439851 | 0.81 | TSHR (0.41) | TSHRDHODHVCPCAPN1PDE9A | |
| SCHEMBL6971891 | 0.78 | ALDH1A1 (0.37) | DHODHCAPN1TACR1ALDH1A1 | |
| SCHEMBL6962115 | 0.76 | ADRB2 (0.32) | MAPK14CAPN1 | |
| SCHEMBL6962307 | 0.76 | CYP1A2 (0.35) | DHODHALDH1A1 | |
| SCHEMBL6971468 | 0.76 | HRH4 (0.36) | CAPN1TACR1ALDH1A1 | |
| SCHEMBL8494052 | 0.75 | CYP19A1 (0.37) | MAPK14 |
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 |