Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 11/20 | 0.50 |
| ▸ | HTT | P42858 | 2/20 | 0.43 |
| ▸ | TP53 | P04637 | 1/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 2/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.38 |
| ▸ | F2 | P00734 | 1/20 | 0.38 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.38 |
| ▸ | PRSS2 | P07478 | 1/20 | 0.38 |
| ▸ | PRSS3 | P35030 | 1/20 | 0.38 |
| ▸ | MMP13 | P45452 | 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 | |
|---|---|---|---|---|
| SCHEMBL30250009 | 0.85 | ALDH1A1 (0.53) | ALDH1A1HTTTP53POLBMAPT | |
| SCHEMBL18824341 | 0.80 | ALDH1A1 (0.62) | ALDH1A1TP53MAPTMEN1KMT2A | |
| SCHEMBL30397615 | 0.79 | ALDH1A1 (0.46) | ALDH1A1HTTTP53POLBMAPT | |
| SCHEMBL21815402 | 0.76 | ALDH1A1 (0.57) | ALDH1A1TP53MAPTMEN1KMT2A | |
| SCHEMBL25339246 | 0.75 | ALDH1A1 (0.57) | ALDH1A1MAPTMEN1KMT2AF2 | |
| SCHEMBL18137607 | 0.74 | KMT2A (0.54) | ALDH1A1HTTTP53MEN1KMT2A | |
| SCHEMBL18228346 | 0.73 | ALDH1A1 (0.70) | ALDH1A1MAPTMEN1KMT2AF2 | |
| SCHEMBL20099653 | 0.72 | KMT2A (0.50) | ALDH1A1MEN1KMT2AMMP13 | |
| SCHEMBL25252374 | 0.72 | ALDH1A1 (0.52) | ALDH1A1TP53POLBMAPTMEN1 | |
| SCHEMBL1250612 | 0.72 | ALDH1A1 (0.53) | ALDH1A1TP53POLBMAPTMEN1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-105384695-A | Pyrimidine derivative, preparation method therefor and application thereof in medicine | SICHUAN HAISCO PHARMACEUTICAL CO LTD | 2016-03-09 | — | — | CN | disclosed |