Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ABCG2 | Q9UNQ0 | 2/20 | 0.53 |
| ▸ | ACP1 | P24666 | 7/20 | 0.52 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.44 |
| ▸ | ABCC1 | P33527 | 1/20 | 0.44 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.40 |
| ▸ | SLC2A1 | P11166 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL8617753 | 0.90 | ACP1 (0.51) | ABCG2ACP1ABCB1ABCC1SLC2A1 | |
| SCHEMBL8614008 | 0.89 | ACP1 (0.50) | ABCG2ACP1ABCB1ABCC1 | |
| SCHEMBL8614861 | 0.88 | AKR1C3 (0.53) | ABCG2ACP1ABCB1ABCC1SLC2A1 | |
| SCHEMBL8614345 | 0.87 | ABCG2 (0.44) | ABCG2ACP1ABCB1ABCC1SLC2A1 | |
| SCHEMBL8614079 | 0.87 | ACP1 (0.52) | ABCG2ACP1ABCB1ABCC1 | |
| SCHEMBL8618948 | 0.87 | MEN1 (0.50) | ABCG2ACP1ABCB1ABCC1 | |
| SCHEMBL8615496 | 0.86 | DHODH (0.50) | ABCG2ACP1ABCB1ABCC1 | |
| SCHEMBL8617537 | 0.86 | ACP1 (0.54) | ABCG2ACP1ABCB1ABCC1 | |
| SCHEMBL8619401 | 0.84 | ABCB1 (0.44) | ABCG2ACP1ABCB1ABCC1 | |
| SCHEMBL8614857 | 0.84 | ABCB1 (0.55) | ABCG2ACP1ABCB1 |
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-0726254-B1 | Quinoline-4-carbonylguanidine derivates, process for producing the same and pharmaceutical preparations containing the compounds | MITSUI TOATSU CHEMICALS (JP) | 1998-05-06 | — | — | EP | disclosed |
| US-5627193-A | MEDICAL DIAGNOSIS, CARDIOVASCULAR DIAORDERS AND PROTECTION OF ORGANS FOR TRANSPLANTATION | MITSUI TOATSU CHEMICALS, INC. (JP) | 1997-05-06 | — | — | US | disclosed |
| EP-0726254-A1 | Quinoline-4-carbonylguanidine derivates, process for producing the same and pharmaceutical preparations containing the compounds | MITSUI TOATSU CHEMICALS, Inc. (JP) | 1996-08-14 | — | — | EP | disclosed |