Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKR1C3 | P42330 | 2/20 | 0.43 |
| ▸ | AKR1C2 | P52895 | 2/20 | 0.43 |
| ▸ | SHMT1 | P34896 | 1/20 | 0.42 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.41 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.41 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.41 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.41 |
| ▸ | CSNK2A1 | P68400 | 1/20 | 0.41 |
| ▸ | CA2 | P00918 | 1/20 | 0.40 |
| ▸ | DPP4 | P27487 | 1/20 | 0.39 |
| ▸ | DPP8 | Q6V1X1 | 1/20 | 0.39 |
| ▸ | DPP9 | Q86TI2 | 1/20 | 0.39 |
| ▸ | DPP7 | Q9UHL4 | 1/20 | 0.39 |
| ▸ | CD274 | Q9NZQ7 | 1/20 | 0.39 |
| ▸ | F3 | P13726 | 1/20 | 0.38 |
| ▸ | PPARA | Q07869 | 1/20 | 0.37 |
| ▸ | LRRK2 | Q5S007 | 1/20 | 0.37 |
| ▸ | SLC1A3 | P43003 | 1/20 | 0.37 |
| ▸ | SLC1A2 | P43004 | 1/20 | 0.37 |
| ▸ | SLC1A1 | P43005 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL1347921 | 0.93 | OPRM1 (0.46) | AKR1C3AKR1C2SHMT1HDAC1OPRM1 | |
| Trifluoroacetic Acid SCHEMBL3342436 | 0.87 | HDAC1 (0.54) | HDAC1OPRM1OPRD1OPRK1CA2 | |
| SCHEMBL13633142 | 0.84 | OPRM1 (0.45) | AKR1C3AKR1C2SHMT1HDAC1OPRM1 | |
| Hydrochloric Acid SCHEMBL4082867 | 0.83 | CA2 (0.46) | AKR1C3AKR1C2SHMT1HDAC1OPRM1 | |
| SCHEMBL4075641 | 0.81 | OPRM1 (0.52) | HDAC1OPRM1OPRD1OPRK1CA2 | |
| Trifluoroacetic Acid SCHEMBL3345691 | 0.81 | HDAC1 (0.52) | HDAC1OPRM1OPRD1OPRK1CA2 | |
| SCHEMBL1347863 | 0.81 | OPRM1 (0.52) | SHMT1HDAC1OPRM1OPRD1OPRK1 | |
| Hydrochloric Acid SCHEMBL4475141 | 0.80 | OPRM1 (0.51) | HDAC1OPRM1OPRD1OPRK1CA2 | |
| SCHEMBL4073644 | 0.79 | OPRM1 (0.53) | HDAC1OPRM1OPRD1OPRK1CA2 | |
| SCHEMBL1345547 | 0.79 | HDAC1 (0.58) | HDAC1OPRM1OPRD1OPRK1CA2 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20140323487-A1 | Novel Compounds As Antagonists Or Inverse Agonists At Opioid Receptors | GLAXOSMITHKLINE LLC | 2014-10-30 | — | — | US | disclosed |
| US-20100113512-A1 | METHOD OF TREATMENT USING NOVEL ANTAGONISTS OR INVERSE AGONISTS AT OPIOID RECEPTORS | IGNAR DIANE MICHELE | 2010-05-06 | — | — | US | disclosed |
Patent text — is the patent's own abstract consistent with the prediction?
For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.
| Patent | Title | Text reads most about | Predicted target · text-rank |
|---|---|---|---|
| US-20100113512-A1 | METHOD OF TREATMENT USING NOVEL ANTAGONISTS OR INVERSE AGONISTS AT OPIOID RECEPTORS | OPRL1, OPRD1, OPRK1 | AKR1C3 2572/4885AKR1C2 1973/4885SHMT1 4648/4885 |
| US-20140323487-A1 | Novel Compounds As Antagonists Or Inverse Agonists At Opioid Receptors | OPRL1, OPRM1, OPRK1 | AKR1C3 2428/4885AKR1C2 2353/4885SHMT1 4472/4885 |
“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.