Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2D6 | P10635 | 1/20 | 0.51 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.51 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.51 |
| ▸ | TSHR | P16473 | 1/20 | 0.51 |
| ▸ | SLC1A3 | P43003 | 1/20 | 0.50 |
| ▸ | SLC1A2 | P43004 | 1/20 | 0.50 |
| ▸ | SLC1A1 | P43005 | 1/20 | 0.50 |
| ▸ | F2 | P00734 | 2/20 | 0.49 |
| ▸ | PRSS1 | P07477 | 2/20 | 0.49 |
| ▸ | PRSS2 | P07478 | 2/20 | 0.49 |
| ▸ | PRSS3 | P35030 | 2/20 | 0.49 |
| ▸ | GAA | P10253 | 1/20 | 0.47 |
| ▸ | MEN1 | O00255 | 6/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 6/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.44 |
| ▸ | BRAF | P15056 | 1/20 | 0.43 |
| ▸ | HKDC1 | Q2TB90 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 3/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL1760879 | 0.85 | CYP2D6 (0.58) | CYP2D6CYP2C9CYP2C19TSHRSLC1A3 | |
| SCHEMBL731549 | 0.82 | CYP2D6 (0.55) | CYP2D6CYP2C9CYP2C19TSHRSLC1A3 | |
| SCHEMBL24254325 | 0.81 | CYP2D6 (0.67) | CYP2D6CYP2C9CYP2C19TSHRGAA | |
| Urea SCHEMBL8693555 | 0.81 | CYP2D6 (0.53) | CYP2D6CYP2C9CYP2C19TSHRSLC1A3 | |
| SCHEMBL28689240 | 0.79 | KAT6A (0.61) | CYP2D6CYP2C9CYP2C19TSHRSLC1A3 | |
| SCHEMBL8337692 | 0.75 | CYP2C9 (0.64) | CYP2D6CYP2C9CYP2C19TSHRGAA | |
| SCHEMBL6934209 | 0.74 | ALDH1A1 (0.57) | CYP2D6CYP2C9CYP2C19TSHRSLC1A3 | |
| SCHEMBL10718657 | 0.74 | CYP2D6 (0.53) | CYP2D6CYP2C9CYP2C19TSHRSLC1A3 | |
| SCHEMBL8232303 | 0.74 | CYP2D6 (0.62) | CYP2D6CYP2C9CYP2C19TSHRSLC1A3 | |
| SCHEMBL1863910 | 0.74 | CYP2D6 (0.62) | CYP2D6CYP2C9CYP2C19TSHRSLC1A3 |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-104822373-A | Therapeutic compounds and compositions | AGIOS PHARMACEUTICALS INC | 2015-08-05 | — | — | CN | disclosed |
| US-20060030596-A1 | NF-kappaB inhibitors | SMITHKLINE BEECHAM CORPORATION | 2006-02-09 | — | — | US | disclosed |
| EP-1324759-A4 | NF-G(K)B INHIBITORS | SMITHKLINE BEECHAM CORP (US) | 2004-05-12 | — | — | EP | disclosed |
| US-20040024047-A1 | Nf-kb inhibitors | SMITHKLINE BEECHMAN CORPORATION | 2004-02-05 | — | — | US | disclosed |
| EP-1324759-A2 | NF-G(K)B INHIBITORS | SmithKline Beecham Corporation (US) | 2003-07-09 | — | — | EP | disclosed |
| WO-2002030353-A2 | NF-λB INHIBITORS | SMITHKLINE BEECHAM CORPORATION (US) | 2002-04-18 | — | — | WO | 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-20060030596-A1 | NF-kappaB inhibitors | NFKBIA, IKBKB, IKBKG | CYP2D6 4539/4885CYP2C9 4706/4885CYP2C19 4750/4885 |
| US-20040024047-A1 | Nf-kb inhibitors | NFKBIA, IKBKB, IKBKG | CYP2D6 4308/4885CYP2C9 4440/4885CYP2C19 4479/4885 |
“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.