Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.47 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.39 |
| ▸ | CA12 | O43570 | 1/20 | 0.39 |
| ▸ | CA1 | P00915 | 1/20 | 0.39 |
| ▸ | CA2 | P00918 | 1/20 | 0.39 |
| ▸ | CA9 | Q16790 | 1/20 | 0.39 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.39 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 3/20 | 0.37 |
| ▸ | TSHR | P16473 | 3/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 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 | |
|---|---|---|---|---|
| SCHEMBL23899723 | 0.80 | ALDH1A1 (0.53) | ALDH1A1HCAR2TDP1MAPK1L3MBTL1 | |
| SCHEMBL17177756 | 0.77 | ALDH1A1 (0.57) | ALDH1A1HCAR2TDP1MAPK1L3MBTL1 | |
| SCHEMBL19901925 | 0.76 | ALDH1A1 (0.48) | ALDH1A1HCAR2TDP1MAPK1L3MBTL1 | |
| SCHEMBL6916614 | 0.74 | ALDH1A1 (0.40) | ALDH1A1HCAR2TDP1MAPK1L3MBTL1 | |
| SCHEMBL20371638 | 0.73 | ALDH1A1 (0.46) | ALDH1A1HCAR2TDP1MAPK1L3MBTL1 | |
| SCHEMBL156493 | 0.73 | ALDH1A1 (0.63) | ALDH1A1HCAR2TDP1MAPK1L3MBTL1 | |
| SCHEMBL873995 | 0.73 | ALDH1A1 (0.63) | ALDH1A1HCAR2TDP1MAPK1L3MBTL1 | |
| SCHEMBL4317881 | 0.73 | ALDH1A1 (0.63) | ALDH1A1HCAR2TDP1MAPK1L3MBTL1 | |
| SCHEMBL23788401 | 0.73 | ALDH1A1 (0.53) | ALDH1A1HCAR2TDP1MAPK1L3MBTL1 | |
| SCHEMBL873996 | 0.73 | ALDH1A1 (0.63) | ALDH1A1HCAR2TDP1MAPK1L3MBTL1 |
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-20170190715-A1 | PYRIDINE DERIVATIVE | ASTELLAS PHARMA INC. (JP) | 2017-07-06 | — | — | 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 (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-20170190715-A1 | PYRIDINE DERIVATIVE | LAP3, PREP, DNPEP | ALDH1A1 360/4885HCAR2 435/4885TDP1 3910/4885 |
“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.