Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKR1B1 | P15121 | 2/20 | 0.31 |
| ▸ | DHFR | P00374 | 1/20 | 0.31 |
| ▸ | POLB | P06746 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL9443757 | 0.89 | CYP1A2 (0.37) | — | |
| SCHEMBL7674659 | 0.77 | CYP1A2 (0.35) | POLB | |
| SCHEMBL94362 | 0.72 | KDM4E (0.33) | DHFR | |
| SCHEMBL94822 | 0.69 | — | — | |
| SCHEMBL1766002 | 0.68 | ADORA2A (0.33) | — | |
| SCHEMBL9465291 | 0.66 | CDK2 (0.39) | — | |
| SCHEMBL5482101 | 0.64 | PNP (0.31) | — | |
| SCHEMBL6424250 | 0.61 | CYP1A2 (0.46) | POLB | |
| Lactic Acid SCHEMBL30381846 | 0.59 | TP53 (0.58) | — | |
| SCHEMBL8826474 | 0.59 | MPO (0.54) | DHFR |
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 |
|---|---|---|---|---|---|---|---|
| US-5213972-A | Production of thymidine and deoxyuridine, intermediates for AZT | CHEMGEN CORPORATION (US) | 1993-05-25 | — | — | US | disclosed |
| WO-1992020816-A1 | DETERMINATION OF PRODRUGS METABOLIZABLE BY THE LIVER AND THERAPEUTIC USE THEREOF | YALE UNIVERSITY (US) | 1992-11-26 | — | — | WO | disclosed |