Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNQ3 | O43525 | 3/20 | 0.37 |
| ▸ | KCNQ2 | O43526 | 3/20 | 0.37 |
| ▸ | KCNQ4 | P56696 | 2/20 | 0.37 |
| ▸ | KCNQ5 | Q9NR82 | 2/20 | 0.37 |
| ▸ | ESR1 | P03372 | 1/20 | 0.36 |
| ▸ | AR | P10275 | 1/20 | 0.36 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 3/20 | 0.35 |
| ▸ | MAPT | P10636 | 2/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.35 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.35 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | FBP1 | P09467 | 1/20 | 0.35 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.35 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.35 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL30853648 | 0.86 | TSHR (0.36) | KCNQ3KCNQ2KCNQ4KCNQ5ESR1 | |
| SCHEMBL14035562 | 0.86 | CNR2 (0.45) | TSHRMAPTKDM4ENPC1RAB9A | |
| SCHEMBL30192734 | 0.86 | CNR2 (0.45) | TSHRMAPTKDM4ENPC1RAB9A | |
| SCHEMBL140210 | 0.86 | TSHR (0.36) | KCNQ3KCNQ2KCNQ4KCNQ5ESR1 | |
| SCHEMBL28015001 | 0.84 | HDAC1 (0.33) | ESR1ARESR2HDAC1HDAC6 | |
| SCHEMBL11156490 | 0.81 | POLB (0.37) | KCNQ3KCNQ2KCNQ4KCNQ5MAPT | |
| SCHEMBL140211 | 0.81 | POLB (0.49) | KCNQ3KCNQ2KCNQ4KCNQ5ESR1 | |
| SCHEMBL112748 | 0.79 | THRB (0.45) | MAPTKDM4ESMN1; SMN2FBP1ALDH1A1 | |
| SCHEMBL8432943 | 0.76 | CNR2 (0.44) | TSHRMAPTOPRK1NPC1RAB9A | |
| SCHEMBL1712071 | 0.75 | PPARA (0.57) | TSHROPRK1FBP1ABCB11CYP1A2 |
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-20120058984-A1 | PYRIMIDINE DERIVATIVES USED AS ITK INHIBITORS | GLAXO GROUP LIMITED (GB) | 2012-03-08 | — | — | 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 (1 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-20120058984-A1 | PYRIMIDINE DERIVATIVES USED AS ITK INHIBITORS | DTYMK, ITK, DCK | KCNQ3 2680/4885KCNQ2 2179/4885KCNQ4 2701/4885 |
“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.