Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.55 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.55 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.55 |
| ▸ | HPGD | P15428 | 1/20 | 0.55 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.55 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.55 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.55 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.55 |
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 | |
|---|---|---|---|---|
| SCHEMBL7971000 | 0.94 | — | — | |
| SCHEMBL12016540 | 0.90 | CYP1A2 (0.60) | CYP1A2CYP3A4CYP2C9HPGDOPRM1 | |
| SCHEMBL29457725 | 0.85 | OPRD1 (0.75) | CYP1A2CYP3A4CYP2C9HPGDOPRM1 | |
| SCHEMBL12018159 | 0.85 | OPRD1 (0.75) | CYP1A2CYP3A4CYP2C9HPGDOPRM1 | |
| SCHEMBL17158189 | 0.85 | OPRD1 (0.75) | CYP1A2CYP3A4CYP2C9HPGDOPRM1 | |
| SCHEMBL4577164 | 0.85 | OPRD1 (0.75) | CYP1A2CYP3A4CYP2C9HPGDOPRM1 | |
| SCHEMBL5143696 | 0.85 | OPRD1 (0.75) | CYP1A2CYP3A4CYP2C9HPGDOPRM1 | |
| SCHEMBL12016542 | 0.85 | CYP1A2 (0.61) | CYP1A2CYP3A4CYP2C9HPGDOPRM1 | |
| SCHEMBL12016538 | 0.84 | OPRD1 (0.58) | CYP1A2CYP3A4CYP2C9HPGDOPRM1 | |
| SCHEMBL14218227 | 0.83 | OPRD1 (0.57) | 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 |