Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SHBG | P04278 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.34 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.34 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.33 |
| ▸ | OPRL1 | P41146 | 1/20 | 0.33 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | DRD2 | P14416 | 1/20 | 0.32 |
| ▸ | DRD3 | P35462 | 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 | |
|---|---|---|---|---|
| SCHEMBL14519155 | 1.00 | SHBG (0.35) | SHBGKDM4ECHRM5ADRA2COPRM1 | |
| SCHEMBL15292513 | 0.94 | CYP3A4 (0.36) | KDM4ECYP1A2CYP2D6CYP3A4DRD2 | |
| SCHEMBL1615683 | 0.94 | CYP3A4 (0.36) | KDM4ECYP1A2CYP2D6CYP3A4DRD2 | |
| SCHEMBL13542421 | 0.94 | CYP3A4 (0.36) | KDM4ECYP1A2CYP2D6CYP3A4DRD2 | |
| SCHEMBL27346203 | 0.88 | KDM4E (0.40) | SHBGKDM4ECHRM5ADRA2COPRM1 | |
| SCHEMBL18664106 | 0.87 | SMN1; SMN2 (0.38) | OPRM1OPRL1 | |
| SCHEMBL4762401 | 0.87 | SMN1; SMN2 (0.38) | OPRM1OPRL1 | |
| SCHEMBL15837587 | 0.87 | SMN1; SMN2 (0.38) | OPRM1OPRL1 | |
| SCHEMBL14519156 | 0.85 | DRD2 (0.42) | DRD2DRD3 | |
| SCHEMBL19214879 | 0.81 | KDM4E (0.41) | SHBGKDM4EOPRM1OPRL1HSD11B1 |
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 |
|---|---|---|---|---|---|---|---|
| US-7199147-B2 | Rho kinase inhibitors | DAINIPPON SUMITOMO PHARMA CO., LTD. (JP) | 2007-04-03 | — | — | US | disclosed |