Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD3 | P35462 | 4/20 | 0.41 |
| ▸ | DRD2 | P14416 | 4/20 | 0.41 |
| ▸ | SIGMAR1 | Q99720 | 3/20 | 0.41 |
| ▸ | DRD4 | P21917 | 3/20 | 0.41 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.41 |
| ▸ | PRCP | P42785 | 1/20 | 0.41 |
| ▸ | EBP | Q15125 | 1/20 | 0.41 |
| ▸ | HTR1A | P08908 | 1/20 | 0.36 |
| ▸ | DRD1 | P21728 | 1/20 | 0.36 |
| ▸ | DRD5 | P21918 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL7874356 | 0.99 | DRD3 (0.40) | DRD3DRD2SIGMAR1DRD4NFKB1 | |
| SCHEMBL6934203 | 0.94 | OPRK1 (0.39) | DRD3DRD2SIGMAR1DRD4NFKB1 | |
| SCHEMBL6937298 | 0.93 | MAP1LC3B (0.39) | DRD3DRD2SIGMAR1DRD4NFKB1 | |
| Hydrochloric Acid SCHEMBL7870761 | 0.93 | OPRK1 (0.39) | DRD3DRD2SIGMAR1DRD4NFKB1 | |
| Hydrochloric Acid SCHEMBL7865265 | 0.92 | MAP1LC3B (0.38) | DRD3DRD2SIGMAR1DRD4NFKB1 | |
| SCHEMBL6937110 | 0.92 | ESR2 (0.37) | DRD3DRD2SIGMAR1DRD4NFKB1 | |
| Hydrochloric Acid SCHEMBL7872662 | 0.91 | ESR2 (0.36) | DRD3DRD2SIGMAR1DRD4NFKB1 | |
| SCHEMBL6933615 | 0.91 | OPRD1 (0.40) | DRD3DRD2SIGMAR1DRD4NFKB1 | |
| SCHEMBL6940430 | 0.90 | SLC6A2 (0.42) | DRD3DRD2SIGMAR1DRD4NFKB1 | |
| Hydrochloric Acid SCHEMBL7872729 | 0.90 | OPRD1 (0.39) | DRD3DRD2SIGMAR1DRD4NFKB1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1010689-B1 | Substituted cycloheptenes, their preparation and use | GRUENENTHAL GMBH (DE) | 2003-01-15 | — | — | EP | claimed |
| EP-1010689-A1 | Substituted cycloheptenes, their preparation and use | Grünenthal GmbH (DE) | 2000-06-21 | — | — | EP | claimed |
| EP-1010689-B1 | Substituted cycloheptenes, their preparation and use | GRUENENTHAL GMBH (DE) | 2003-01-15 | — | — | EP | disclosed |
| EP-1010689-A1 | Substituted cycloheptenes, their preparation and use | Grünenthal GmbH (DE) | 2000-06-21 | — | — | EP | disclosed |