Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.66 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.66 |
| ▸ | POLB | P06746 | 1/20 | 0.66 |
| ▸ | DHFR | P00374 | 1/20 | 0.60 |
| ▸ | EGFR | P00533 | 1/20 | 0.58 |
| ▸ | USP2 | O75604 | 1/20 | 0.56 |
| ▸ | GLA | P06280 | 1/20 | 0.56 |
| ▸ | HTT | P42858 | 1/20 | 0.56 |
| ▸ | CA1 | P00915 | 2/20 | 0.55 |
| ▸ | CA2 | P00918 | 2/20 | 0.55 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.53 |
| ▸ | GUSB | P08236 | 2/20 | 0.52 |
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 | |
|---|---|---|---|---|
| SCHEMBL7691437 | 0.86 | ALDH1A1 (0.65) | ALDH1A1KMT2APOLBDHFREGFR | |
| SCHEMBL13419901 | 0.85 | ALDH1A1 (0.63) | ALDH1A1KMT2APOLBDHFRHTT | |
| SCHEMBL7695774 | 0.85 | CA1 (0.70) | ALDH1A1KMT2APOLBDHFRHTT | |
| SCHEMBL7690576 | 0.85 | DHFR (0.76) | ALDH1A1KMT2APOLBDHFRHTT | |
| SCHEMBL7691490 | 0.84 | DHFR (0.62) | ALDH1A1KMT2APOLBDHFRUSP2 | |
| SCHEMBL10144688 | 0.84 | EGFR (0.60) | ALDH1A1KMT2APOLBDHFREGFR | |
| SCHEMBL7694652 | 0.83 | DHFR (0.63) | ALDH1A1KMT2APOLBDHFREGFR | |
| SCHEMBL14164070 | 0.82 | DHFR (0.79) | ALDH1A1DHFRHTTCA1CA2 | |
| SCHEMBL16323579 | 0.80 | DHFR (0.69) | DHFRCA1CA2 | |
| SCHEMBL22972227 | 0.80 | EGFR (0.60) | ALDH1A1POLBDHFREGFRHTT |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2002066443-A2 | 2-THIOXO-1,2,3,4-TETRAHYDROPYRIMIDINE DERIVATIVES | ONO PHARMACEUTICAL CO., LTD. (JP) | 2002-08-29 | — | — | WO | claimed |
| WO-2002066443-A2 | 2-THIOXO-1,2,3,4-TETRAHYDROPYRIMIDINE DERIVATIVES | ONO PHARMACEUTICAL CO., LTD. (JP) | 2002-08-29 | — | — | WO | disclosed |