Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP11B1 | P15538 | 1/20 | 0.41 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.41 |
| ▸ | ITGB2 | P05107 | 4/20 | 0.41 |
| ▸ | ICAM1 | P05362 | 4/20 | 0.41 |
| ▸ | ITGAL | P20701 | 4/20 | 0.41 |
| ▸ | SYK | P43405 | 2/20 | 0.39 |
| ▸ | SSTR4 | P31391 | 4/20 | 0.39 |
| ▸ | ACACB | O00763 | 2/20 | 0.38 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.38 |
| ▸ | SSTR1 | P30872 | 2/20 | 0.38 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.38 |
| ▸ | GRM2 | Q14416 | 2/20 | 0.37 |
| ▸ | KIF11 | P52732 | 1/20 | 0.36 |
| ▸ | USP30 | Q70CQ3 | 1/20 | 0.36 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL21434088 | 0.88 | SSTR4 (0.42) | ITGB2ICAM1ITGALSYKSSTR4 | |
| SCHEMBL21433976 | 0.88 | SSTR4 (0.42) | ITGB2ICAM1ITGALSYKSSTR4 | |
| SCHEMBL21433978 | 0.88 | SSTR4 (0.42) | ITGB2ICAM1ITGALSYKSSTR4 | |
| SCHEMBL21452611 | 0.88 | SSTR4 (0.42) | ITGB2ICAM1ITGALSYKSSTR4 | |
| SCHEMBL21452935 | 0.86 | ITGB2 (0.53) | CYP11B1CYP11B2ITGB2ICAM1ITGAL | |
| SCHEMBL21434084 | 0.86 | ITGB2 (0.45) | CYP11B1CYP11B2ITGB2ICAM1ITGAL | |
| SCHEMBL21452717 | 0.79 | SSTR1 (0.41) | ITGB2ICAM1ITGALSSTR4ACACB | |
| SCHEMBL21433940 | 0.79 | SSTR1 (0.41) | ITGB2ICAM1ITGALSSTR4ACACB | |
| SCHEMBL21433945 | 0.79 | ABL1 (0.38) | ITGB2ICAM1ITGALACACBHRH4 | |
| SCHEMBL21453065 | 0.78 | HRH4 (0.39) | CYP11B1CYP11B2NOTUMHRH4GRM2 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2019193516-A2 | SUBSTITUTED PYRIDINE AND PYRIMIDINES AND THEIR USE AS GLUN2B RECEPTOR MODULATORS | JANSSEN PHARMACEUTICA NV (BE) | 2019-10-10 | — | — | WO | disclosed |