Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 2/20 | 0.38 |
| ▸ | ESR2 | Q92731 | 2/20 | 0.38 |
| ▸ | CTRB1 | P17538 | 1/20 | 0.38 |
| ▸ | MAP2K5 | Q13163 | 1/20 | 0.37 |
| ▸ | MAPK7 | Q13164 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 2/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.37 |
| ▸ | SRC | P12931 | 1/20 | 0.37 |
| ▸ | NOS3 | P29474 | 1/20 | 0.36 |
| ▸ | NOS1 | P29475 | 1/20 | 0.36 |
| ▸ | NOS2 | P35228 | 1/20 | 0.36 |
| ▸ | KCNN4 | O15554 | 1/20 | 0.36 |
| ▸ | PTPRB | P23467 | 1/20 | 0.36 |
| ▸ | MRGPRX4 | Q96LA9 | 1/20 | 0.36 |
| ▸ | AAK1 | Q2M2I8 | 1/20 | 0.36 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.35 |
| ▸ | CETP | P11597 | 1/20 | 0.35 |
| ▸ | LOXL2 | Q9Y4K0 | 1/20 | 0.35 |
| ▸ | ELANE | P08246 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL28808224 | 0.79 | CTRB1 (0.50) | CTRB1MEN1KMT2ASRCKCNN4 | |
| SCHEMBL20103531 | 0.75 | PDK1 (0.48) | CTRB1MEN1KMT2APTPRBMRGPRX4 | |
| SCHEMBL20103587 | 0.75 | PTPRB (0.40) | CTRB1MEN1KMT2APTPRBMRGPRX4 | |
| SCHEMBL20103481 | 0.75 | SIRT2 (0.46) | MAP2K5MAPK7MEN1KMT2ANOS1 | |
| SCHEMBL20103561 | 0.74 | CYP4F2 (0.43) | CTRB1MEN1KMT2APTPRBMRGPRX4 | |
| SCHEMBL20103512 | 0.72 | PTPRB (0.46) | MEN1KMT2APTPRBPTPN1 | |
| SCHEMBL21688306 | 0.71 | FFAR1 (0.41) | ESR1ESR2MEN1KMT2ASRC | |
| SCHEMBL20103376 | 0.71 | FFAR1 (0.41) | ESR1ESR2MEN1KMT2ASRC | |
| SCHEMBL20103651 | 0.71 | PTPRB (0.39) | CTRB1MEN1KMT2APTPRBMRGPRX4 | |
| SCHEMBL4492960 | 0.70 | ITGB3 (0.48) | — |
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-2018081047-A1 | CYCLOHEXYL GPR40 AGONISTS FOR THE TREATMENT OF TYPE II DIABETES | JANSSEN PHARMACEUTICA NV (BE) | 2018-05-03 | — | — | WO | disclosed |