Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.44 |
| ▸ | MEN1 | O00255 | 3/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.44 |
| ▸ | MAPT | P10636 | 2/20 | 0.44 |
| ▸ | USP2 | O75604 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 2/20 | 0.40 |
| ▸ | TSHR | P16473 | 2/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL28452624 | 0.66 | ALDH1A1 (0.54) | HSD17B10ALDH1A1MEN1KMT2AMAPT | |
| SCHEMBL7820085 | 0.65 | ALDH1A1 (0.61) | HSD17B10ALDH1A1MEN1KMT2AMAPT | |
| SCHEMBL3842559 | 0.65 | ALDH1A1 (0.45) | HSD17B10ALDH1A1MEN1KMT2AMAPT | |
| SCHEMBL18202990 | 0.64 | HTT (0.62) | HSD17B10ALDH1A1MAPTHTTTSHR | |
| SCHEMBL862369 | 0.64 | — | — | |
| SCHEMBL8443681 | 0.63 | MEN1 (0.59) | HSD17B10ALDH1A1MEN1KMT2AMAPT | |
| SCHEMBL10934212 | 0.63 | HTT (0.51) | HSD17B10ALDH1A1MEN1KMT2AMAPT | |
| SCHEMBL9198774 | 0.63 | HSD17B10 (0.57) | HSD17B10ALDH1A1MEN1KMT2AMAPT | |
| SCHEMBL1619449 | 0.63 | ALDH1A1 (0.68) | HSD17B10ALDH1A1MEN1KMT2AMAPT | |
| SCHEMBL448303 | 0.62 | HTT (0.50) | HSD17B10ALDH1A1MEN1KMT2AMAPT |
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 |
|---|---|---|---|---|---|---|---|
| WO-2011019405-A1 | PYRIMIDINE COMPOUNDS AS TUBERCULOSIS INHIBITORS | VERTEX PHARMACEUTICALS INCORPORATED (US) | 2011-02-17 | — | — | WO | disclosed |