Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DHODH | Q02127 | 1/20 | 0.33 |
| ▸ | GCGR | P47871 | 1/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
| ▸ | POLB | P06746 | 1/20 | 0.31 |
| ▸ | PKM | P14618 | 1/20 | 0.31 |
| ▸ | HTT | P42858 | 1/20 | 0.31 |
| ▸ | DHFR | P00374 | 1/20 | 0.31 |
| ▸ | HAO1 | Q9UJM8 | 1/20 | 0.30 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.30 |
| ▸ | ATM | Q13315 | 1/20 | 0.30 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | LMNA | P02545 | 1/20 | 0.30 |
| ▸ | MAPT | P10636 | 1/20 | 0.30 |
| ▸ | SLC6A9 | P48067 | 2/20 | 0.30 |
| ▸ | CA2 | P00918 | 1/20 | 0.30 |
| ▸ | CA4 | P22748 | 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 | |
|---|---|---|---|---|
| SCHEMBL6970820 | 1.00 | DHODH (0.33) | DHODHGCGRKDM4EPOLBPKM | |
| SCHEMBL6960789 | 0.89 | ALDH1A1 (0.30) | ALDH1A1LMNAMAPT | |
| SCHEMBL6960785 | 0.89 | ALDH1A1 (0.30) | ALDH1A1LMNAMAPT | |
| SCHEMBL6973441 | 0.87 | TP53 (0.35) | POLBKMT2AALDH1A1LMNAMAPT | |
| SCHEMBL6973443 | 0.87 | TP53 (0.35) | POLBKMT2AALDH1A1LMNAMAPT | |
| SCHEMBL6975065 | 0.87 | ALDH1A1 (0.37) | GCGRKDM4EPOLBPKMHTT | |
| SCHEMBL6975062 | 0.87 | ALDH1A1 (0.37) | GCGRKDM4EPOLBPKMHTT | |
| SCHEMBL6973380 | 0.86 | GRIN1 (0.36) | HTTKMT2AATMALDH1A1LMNA | |
| SCHEMBL6973384 | 0.86 | GRIN1 (0.36) | HTTKMT2AATMALDH1A1LMNA | |
| SCHEMBL6969992 | 0.86 | KDM4E (0.39) | KDM4EHAO1 |
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 3 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 |