Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.41 |
| ▸ | OPRD1 | P41143 | 8/20 | 0.37 |
| ▸ | SLC6A4 | P31645 | 3/20 | 0.35 |
| ▸ | CA2 | P00918 | 2/20 | 0.34 |
| ▸ | CA12 | O43570 | 1/20 | 0.34 |
| ▸ | CA1 | P00915 | 1/20 | 0.34 |
| ▸ | CA9 | Q16790 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.34 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.34 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.34 |
| ▸ | CHKA | P35790 | 1/20 | 0.33 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL25415951 | 0.89 | CYP1A2 (0.39) | SIGMAR1OPRD1 | |
| SCHEMBL31222588 | 0.89 | CYP1A2 (0.39) | SIGMAR1OPRD1 | |
| SCHEMBL28381198 | 0.89 | CYP1A2 (0.39) | SIGMAR1OPRD1 | |
| SCHEMBL29926143 | 0.89 | SIGMAR1 (0.47) | SIGMAR1SLC6A4CHRM3SLC6A2SLC6A3 | |
| SCHEMBL28478812 | 0.88 | SIGMAR1 (0.39) | SIGMAR1OPRD1SLC6A4CA2CA12 | |
| SCHEMBL28335967 | 0.86 | CYP1A2 (0.41) | SIGMAR1OPRD1 | |
| SCHEMBL1401532 | 0.86 | SIGMAR1 (0.38) | SIGMAR1OPRD1SLC6A4 | |
| SCHEMBL30598638 | 0.86 | SIGMAR1 (0.38) | SIGMAR1OPRD1SLC6A4CA2CA12 | |
| SCHEMBL29004649 | 0.86 | SIGMAR1 (0.48) | SIGMAR1SLC6A4CHRM3SLC6A2SLC6A3 | |
| SCHEMBL9158636 | 0.86 | SIGMAR1 (0.37) | SIGMAR1OPRD1SLC6A4CA2CA12 |
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 |
|---|---|---|---|---|---|---|---|
| US-5958373-A | Polychelants as contrast enhancing agents | NYCOMED SALUTAR INC. (US) | 1999-09-28 | — | — | US | disclosed |
| EP-0717737-B1 | CHELANTS AS CONTRAST ENHANCING AGENTS | NYCOMED SALUTAR INC (US) | 1999-04-07 | — | — | EP | disclosed |
| EP-0717737-A1 | CHELANTS AS CONTRAST ENHANCING AGENTS | NYCOMED SALUTAR, INC. (US) | 1996-06-26 | — | — | EP | disclosed |
| WO-1995007270-A1 | CHELANTS AS CONTRAST ENHANCING AGENTS | NYCOMED SALUTAR, INC. (US) | 1995-03-16 | — | — | WO | disclosed |