Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.44 |
| ▸ | HPGD | P15428 | 1/20 | 0.44 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.44 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.44 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.44 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL7971327 | 0.91 | CYP1A2 (0.47) | CYP1A2CYP3A4CYP2C9HPGDOPRM1 | |
| SCHEMBL7971031 | 0.91 | — | — | |
| SCHEMBL7967851 | 0.90 | CYP1A2 (0.45) | CYP1A2CYP3A4CYP2C9HPGDOPRM1 | |
| SCHEMBL7973891 | 0.89 | OPRD1 (0.58) | CYP1A2CYP3A4CYP2C9HPGDOPRM1 | |
| SCHEMBL7971356 | 0.85 | — | — | |
| SCHEMBL7974101 | 0.83 | CYP1A2 (0.47) | CYP1A2CYP3A4CYP2C9HPGDOPRM1 | |
| SCHEMBL7973630 | 0.80 | OPRD1 (0.60) | CYP1A2CYP3A4CYP2C9HPGDOPRM1 | |
| SCHEMBL7970812 | 0.80 | CYP1A2 (0.48) | CYP1A2CYP3A4CYP2C9HPGDOPRM1 | |
| SCHEMBL7971009 | 0.80 | OPRD1 (0.44) | OPRD1 | |
| SCHEMBL7973770 | 0.79 | OPRD1 (0.54) | CYP1A2CYP3A4CYP2C9HPGDOPRM1 |
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-6200978-B1 | FOR PREVENTING OR TREATING INFLAMMATORY DISEASES SUCH AS ARTHRITIS, PSORIASIS, ASTHMA, OR INFLAMMATORY BOWEL DISEASE, DISORDERS OF RESPIRATORY FUNCTION, GASTROINTESTINAL DISORDERS SUCH AS FUNCTIONAL BOWEL DISEASE, AS ANALGESICS | PFIZER INC. | 2001-03-13 | — | — | US | disclosed |