Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CASP2 | P42575 | 1/20 | 0.42 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 2/20 | 0.41 |
| ▸ | CNR1 | P21554 | 2/20 | 0.41 |
| ▸ | NAAA | Q02083 | 1/20 | 0.40 |
| ▸ | FAAH | O00519 | 3/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.37 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 2/20 | 0.37 |
| ▸ | DNM1 | Q05193 | 2/20 | 0.37 |
| ▸ | MMP1 | P03956 | 1/20 | 0.36 |
| ▸ | MMP2 | P08253 | 1/20 | 0.36 |
| ▸ | MMP3 | P08254 | 1/20 | 0.36 |
| ▸ | MMP9 | P14780 | 1/20 | 0.36 |
| ▸ | RECQL | P46063 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 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 | |
|---|---|---|---|---|
| SCHEMBL25516099 | 1.00 | CASP2 (0.42) | CASP2MCL1TSHRCNR1NAAA | |
| SCHEMBL2124347 | 0.98 | CASP2 (0.44) | CASP2MCL1TSHRCNR1NAAA | |
| SCHEMBL21233609 | 0.93 | TSHR (0.49) | CASP2TSHRCNR1NAAAFAAH | |
| SCHEMBL24982767 | 0.92 | MEN1 (0.46) | CASP2TSHRCNR1NAAAFAAH | |
| SCHEMBL19544544 | 0.92 | MEN1 (0.46) | CASP2TSHRCNR1NAAAFAAH | |
| SCHEMBL23711864 | 0.90 | SMN1; SMN2 (0.44) | CASP2MCL1TSHRCNR1NAAA | |
| SCHEMBL16560390 | 0.90 | EPHX2 (0.45) | CASP2TSHRCNR1NAAAFAAH | |
| SCHEMBL23340012 | 0.89 | EPHX2 (0.41) | CASP2MCL1TSHRCNR1NAAA | |
| SCHEMBL23339523 | 0.89 | EPHX2 (0.41) | CASP2MCL1TSHRCNR1NAAA | |
| SCHEMBL19703888 | 0.89 | CASP2 (0.40) | CASP2MCL1TSHRCNR1NAAA |
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-2023078813-A1 | HETEROBIFUNCTIONAL MOLECULES AS TEAD INHIBITORS | MERCK PATENT GMBH (DE) | 2023-05-11 | — | — | WO | disclosed |