Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRM2 | Q14416 | 1/20 | 0.45 |
| ▸ | GRM3 | Q14832 | 1/20 | 0.45 |
| ▸ | DPP4 | P27487 | 1/20 | 0.43 |
| ▸ | EPHX2 | P34913 | 2/20 | 0.43 |
| ▸ | CTSL | P07711 | 1/20 | 0.41 |
| ▸ | CTSB | P07858 | 1/20 | 0.41 |
| ▸ | CTSK | P43235 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | OPRM1 | P35372 | 2/20 | 0.40 |
| ▸ | OPRL1 | P41146 | 2/20 | 0.40 |
| ▸ | SLC1A3 | P43003 | 2/20 | 0.39 |
| ▸ | SLC1A2 | P43004 | 2/20 | 0.39 |
| ▸ | SLC1A1 | P43005 | 2/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | PDPK1 | O15530 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL27917553 | 0.86 | OPRM1 (0.41) | GRM2GRM3DPP4EPHX2CTSL | |
| SCHEMBL14409083 | 0.81 | GRM2 (0.47) | GRM2GRM3DPP4EPHX2CTSL | |
| SCHEMBL296907 | 0.81 | GRM2 (0.47) | GRM2GRM3DPP4EPHX2CTSL | |
| SCHEMBL22509327 | 0.81 | EPHX2 (0.43) | GRM2GRM3DPP4EPHX2CTSL | |
| SCHEMBL15316801 | 0.80 | DPP4 (0.44) | GRM2GRM3DPP4EPHX2CTSL | |
| SCHEMBL28055036 | 0.80 | DPP4 (0.50) | GRM2GRM3DPP4EPHX2CTSL | |
| SCHEMBL7936878 | 0.78 | DPP4 (0.46) | GRM2GRM3DPP4EPHX2CTSL | |
| SCHEMBL2640274 | 0.78 | EPHX2 (0.47) | GRM2GRM3DPP4EPHX2CTSL | |
| SCHEMBL31471412 | 0.77 | DPP4 (0.44) | GRM2GRM3DPP4EPHX2CTSL | |
| SCHEMBL23274871 | 0.77 | EPHX2 (0.44) | GRM2GRM3DPP4EPHX2CTSL |
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-2010097374-A1 | COMPOUNDS FOR USE AS BRADYKININ B1 ANTAGONISTS | BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) | 2010-09-02 | — | — | WO | disclosed |