Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 2/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.37 |
| ▸ | S1PR3 | Q99500 | 7/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | RHEB | Q15382 | 1/20 | 0.36 |
| ▸ | XIAP | P98170 | 1/20 | 0.35 |
| ▸ | BIRC2 | Q13490 | 1/20 | 0.35 |
| ▸ | BACE1 | P56817 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | TP53 | P04637 | 2/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL7085418 | 0.93 | POLB (0.38) | KMT2AALDH1A1ADRA1DS1PR3NPC1 | |
| SCHEMBL6973437 | 0.92 | MEN1 (0.40) | MEN1KMT2AALDH1A1S1PR3NPC1 | |
| SCHEMBL7082911 | 0.90 | ALDH1A1 (0.40) | MEN1KMT2AALDH1A1S1PR3NPC1 | |
| SCHEMBL6970221 | 0.89 | S1PR3 (0.41) | ALDH1A1S1PR3 | |
| SCHEMBL6974447 | 0.88 | MEN1 (0.34) | MEN1KMT2AALDH1A1S1PR3RHEB | |
| SCHEMBL6966022 | 0.87 | ADRA1D (0.36) | MEN1KMT2AALDH1A1ADRA1DS1PR3 | |
| SCHEMBL6970129 | 0.86 | S1PR3 (0.40) | KMT2AALDH1A1S1PR3HPGD | |
| SCHEMBL6975001 | 0.86 | ALDH1A1 (0.33) | MEN1KMT2AALDH1A1ADRA1DXIAP | |
| SCHEMBL6976953 | 0.86 | ALDH1A1 (0.33) | MEN1KMT2AALDH1A1ADRA1DS1PR3 | |
| SCHEMBL6973271 | 0.86 | POLB (0.35) | MEN1KMT2AALDH1A1HPGDTP53 |
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 |