Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 3/20 | 0.57 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.57 |
| ▸ | TSHR | P16473 | 1/20 | 0.57 |
| ▸ | TMPRSS4 | Q9NRS4 | 1/20 | 0.55 |
| ▸ | CA12 | O43570 | 1/20 | 0.51 |
| ▸ | CA1 | P00915 | 1/20 | 0.51 |
| ▸ | CA2 | P00918 | 1/20 | 0.51 |
| ▸ | CA9 | Q16790 | 1/20 | 0.51 |
| ▸ | KDR | P35968 | 3/20 | 0.48 |
| ▸ | IDH1 | O75874 | 1/20 | 0.47 |
| ▸ | PDK1 | Q15118 | 1/20 | 0.45 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.45 |
| ▸ | PDK3 | Q15120 | 1/20 | 0.45 |
| ▸ | PDK4 | Q16654 | 1/20 | 0.45 |
| ▸ | TACR1 | P25103 | 1/20 | 0.45 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.45 |
| ▸ | NTRK1 | P04629 | 1/20 | 0.45 |
| ▸ | RET | P07949 | 1/20 | 0.45 |
| ▸ | PDGFRB | P09619 | 1/20 | 0.45 |
| ▸ | LTK | P29376 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL19669082 | 1.00 | MEN1 (0.57) | MEN1KMT2ATSHRTMPRSS4CA12 | |
| SCHEMBL18205840 | 0.90 | MEN1 (0.57) | MEN1KMT2ATSHRTMPRSS4CA12 | |
| SCHEMBL13015660 | 0.87 | KIF11 (0.52) | MEN1KMT2ATSHRTMPRSS4CA1 | |
| SCHEMBL12126017 | 0.83 | MEN1 (0.60) | MEN1KMT2ATSHRTMPRSS4CA12 | |
| SCHEMBL30977684 | 0.83 | MEN1 (0.60) | MEN1KMT2ATSHRTMPRSS4CA12 | |
| SCHEMBL14568587 | 0.83 | CFTR (0.51) | MEN1KMT2ATACR1ALDH1A1ALOX12 | |
| SCHEMBL8946084 | 0.82 | GAA (0.48) | MEN1KMT2APDK1PDK2PDK3 | |
| SCHEMBL3618813 | 0.81 | MEN1 (0.61) | MEN1KMT2ATSHRTMPRSS4CA12 | |
| SCHEMBL14254883 | 0.81 | HTT (0.55) | MEN1KMT2ATSHRPDK1PDK2 | |
| SCHEMBL1634759 | 0.81 | MAPT (0.56) | MEN1KMT2APDK1PDK2PDK3 |
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-4090660-A1 | QUINOXALINE DERIVATIVES | Grünenthal GmbH (DE) | 2022-11-23 | — | — | EP | disclosed |