Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GCK | P35557 | 2/20 | 0.40 |
| ▸ | WNT1 | P04628 | 2/20 | 0.40 |
| ▸ | GSK3B | P49841 | 2/20 | 0.40 |
| ▸ | DYRK1A | Q13627 | 2/20 | 0.40 |
| ▸ | TSHR | P16473 | 2/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.39 |
| ▸ | HCAR3 | P49019 | 5/20 | 0.39 |
| ▸ | HDAC1 | Q13547 | 3/20 | 0.39 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.39 |
| ▸ | NNMT | P40261 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 2/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | TP53 | P04637 | 1/20 | 0.36 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.36 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.36 |
| ▸ | RELA | Q04206 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 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 | |
|---|---|---|---|---|
| SCHEMBL29854816 | 1.00 | GCK (0.40) | GCKWNT1GSK3BDYRK1ATSHR | |
| SCHEMBL29860906 | 0.82 | GCK (0.43) | GCKWNT1GSK3BDYRK1ATSHR | |
| SCHEMBL4409319 | 0.81 | PTK2 (0.54) | TSHRHCAR3HDAC1HDAC6NNMT | |
| SCHEMBL14973431 | 0.79 | HCAR3 (0.47) | TSHRHCAR3HDAC1HDAC6NNMT | |
| SCHEMBL24932388 | 0.76 | RAB9A (0.64) | NPSR1RAB9AMAPTTP53SMN1; SMN2 | |
| SCHEMBL24932386 | 0.76 | DEGS1 (0.53) | — | |
| SCHEMBL24932333 | 0.75 | DEGS1 (0.49) | WNT1GSK3BDYRK1ATSHRRAB9A | |
| SCHEMBL1483582 | 0.75 | HDAC1 (0.49) | TSHRHCAR3HDAC1NNMTRAB9A | |
| SCHEMBL24932390 | 0.75 | PTK2 (0.63) | TSHRNPSR1RAB9AMAPTTP53 | |
| SCHEMBL24932387 | 0.75 | WNT1 (0.43) | WNT1GSK3BDYRK1ATSHRNPSR1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-114901280-A | MrgprX2 antagonists and uses thereof | 德米拉公司 | 2022-08-12 | — | — | CN | disclosed |