Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAP3K7 | O43318 | 1/20 | 0.40 |
| ▸ | TAB1 | Q15750 | 1/20 | 0.40 |
| ▸ | ACACB | O00763 | 17/20 | 0.39 |
| ▸ | NUDT1 | P36639 | 1/20 | 0.37 |
| ▸ | KCNJ5 | P48544 | 1/20 | 0.33 |
| ▸ | KCNJ3 | P48549 | 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 | |
|---|---|---|---|---|
| SCHEMBL20000527 | 0.80 | MAP3K7 (0.40) | MAP3K7TAB1ACACBNUDT1 | |
| SCHEMBL20000556 | 0.68 | ACACB (0.58) | ACACB | |
| SCHEMBL5388194 | 0.66 | IL1B (0.35) | MAP3K7TAB1NUDT1KCNJ5KCNJ3 | |
| SCHEMBL17341014 | 0.65 | PI4KA (0.35) | — | |
| SCHEMBL20000528 | 0.64 | ACACB (0.36) | ACACBNUDT1 | |
| SCHEMBL15599221 | 0.63 | PTGS2 (0.51) | NUDT1KCNJ5KCNJ3 | |
| SCHEMBL28510200 | 0.63 | RET (0.55) | — | |
| SCHEMBL28506112 | 0.63 | MAP4K4 (0.49) | — | |
| SCHEMBL29692508 | 0.63 | RET (0.55) | — | |
| SCHEMBL19171821 | 0.63 | SSTR4 (0.39) | MAP3K7TAB1NUDT1KCNJ5KCNJ3 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2997024-B1 | PYRROLIDINE DERIVATIVES, PHARMACEUTICAL COMPOSITIONS AND USES THEREOF | BOEHRINGER INGELHEIM INT (DE) | 2018-03-28 | — | — | EP | disclosed |