Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE4B | Q07343 | 2/20 | 0.39 |
| ▸ | MAPK13 | O15264 | 2/20 | 0.36 |
| ▸ | MAPK12 | P53778 | 2/20 | 0.36 |
| ▸ | MAPK11 | Q15759 | 2/20 | 0.36 |
| ▸ | MAPK14 | Q16539 | 2/20 | 0.36 |
| ▸ | CASP6 | P55212 | 2/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | P2RX7 | Q99572 | 7/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | GRM5 | P41594 | 2/20 | 0.34 |
| ▸ | CNR1 | P21554 | 1/20 | 0.33 |
| ▸ | OXTR | P30559 | 2/20 | 0.33 |
| ▸ | HCRTR1 | O43613 | 1/20 | 0.32 |
| ▸ | HCRTR2 | O43614 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL20118221 | 0.87 | MAPK13 (0.38) | PDE4BMAPK13MAPK12MAPK11MAPK14 | |
| SCHEMBL20118039 | 0.81 | KMT2A (0.46) | MAPK13MAPK12MAPK11MAPK14CASP6 | |
| SCHEMBL20118399 | 0.73 | P2RX7 (0.39) | MAPK13MAPK12MAPK11MAPK14CASP6 | |
| SCHEMBL20103445 | 0.68 | P2RX7 (0.52) | CASP6KMT2AMEN1GAAP2RX7 | |
| SCHEMBL20118223 | 0.68 | GRM5 (0.33) | P2RX7ALDH1A1GRM5OXTR | |
| SCHEMBL20118389 | 0.68 | GRM5 (0.33) | P2RX7ALDH1A1GRM5OXTR | |
| SCHEMBL20118222 | 0.68 | OPRL1 (0.34) | CASP6KMT2AMEN1GAAP2RX7 | |
| SCHEMBL20118049 | 0.67 | CASP6 (0.36) | CASP6KMT2AMEN1GAAP2RX7 | |
| SCHEMBL20118185 | 0.67 | OPRM1 (0.35) | CASP6KMT2AMEN1GAAP2RX7 | |
| SCHEMBL20118237 | 0.65 | MEN1 (0.41) | CASP6KMT2AMEN1GAAP2RX7 |
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-2018078009-A1 | AMIDO-SUBSTITUTED CYCLOHEXANE DERIVATIVES | BAYER PHARMA AKTIENGESELLSCHAFT (DE) | 2018-05-03 | — | — | WO | disclosed |