Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | OPRL1 | P41146 | 2/20 | 0.44 |
| ▸ | HCRTR2 | O43614 | 3/20 | 0.40 |
| ▸ | DRD4 | P21917 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | ADRA1A | P35348 | 2/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | CCRL2 | O00421 | 1/20 | 0.35 |
| ▸ | CCR2 | P41597 | 1/20 | 0.35 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.35 |
| ▸ | CNR2 | P34972 | 1/20 | 0.35 |
| ▸ | GRM2 | Q14416 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 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 | |
|---|---|---|---|---|
| SCHEMBL7932450 | 0.82 | OPRL1 (0.48) | OPRL1HCRTR2DRD4KDM4EADRA1A | |
| SCHEMBL7106832 | 0.82 | GRIN2B (0.49) | OPRL1KDM4ERAB9AKMT2A | |
| SCHEMBL3167985 | 0.82 | ADRA1A (0.49) | OPRL1HCRTR2DRD4KDM4EADRA1A | |
| SCHEMBL29580963 | 0.82 | ADRA1A (0.49) | OPRL1HCRTR2DRD4KDM4EADRA1A | |
| Hydrochloric Acid SCHEMBL7936704 | 0.81 | OPRL1 (0.47) | OPRL1HCRTR2DRD4KDM4EADRA1A | |
| Hydrochloric Acid SCHEMBL7934160 | 0.81 | OPRL1 (0.47) | OPRL1HCRTR2DRD4KDM4EADRA1A | |
| Hydrochloric Acid SCHEMBL7934158 | 0.81 | OPRL1 (0.47) | OPRL1HCRTR2DRD4KDM4EADRA1A | |
| SCHEMBL8003101 | 0.80 | DRD4 (0.42) | OPRL1HCRTR2DRD4KDM4EADRA1A | |
| SCHEMBL8178976 | 0.79 | OPRL1 (0.43) | OPRL1HCRTR2DRD4KDM4EADRA1A | |
| SCHEMBL2019967 | 0.75 | ADRA1A (0.46) | HCRTR2DRD4KDM4EADRA1AGRM2 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2000025782-A1 | DIHYDROPYRIDINONES AND PYRROLINONES USEFUL AS ALPHA 1A ADRENOCEPTOR ANTAGONISTS | MERCK & CO., INC. (US) | 2000-05-11 | — | — | WO | claimed |
| WO-2000025782-A1 | DIHYDROPYRIDINONES AND PYRROLINONES USEFUL AS ALPHA 1A ADRENOCEPTOR ANTAGONISTS | MERCK & CO., INC. (US) | 2000-05-11 | — | — | WO | disclosed |
| WO-2000023403-A1 | COMPOSITION AND PROCESS FOR USE IN SELECTIVE HYDROGENATION OF HYDROCARBONS | PHILLIPS PETROLEUM COMPANY (US) | 2000-04-27 | — | — | WO | disclosed |