Predicted protein targets (top 1)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DHFR | P00374 | 7/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL9544509 | 0.81 | DHFR (0.50) | DHFR | |
| SCHEMBL9542054 | 0.80 | DHFR (0.47) | DHFR | |
| SCHEMBL9540646 | 0.76 | DHFR (0.45) | DHFR | |
| SCHEMBL9544503 | 0.74 | DHFR (0.40) | DHFR | |
| SCHEMBL9068396 | 0.67 | DHFR (0.60) | DHFR | |
| SCHEMBL6705618 | 0.66 | ALDH1A1 (0.56) | — | |
| SCHEMBL6705621 | 0.66 | ALDH1A1 (0.56) | — | |
| SCHEMBL12733085 | 0.66 | PTPN1 (0.52) | DHFR | |
| SCHEMBL5462527 | 0.66 | DHFR (0.58) | DHFR | |
| SCHEMBL9534963 | 0.65 | DHFR (0.38) | 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 |
|---|---|---|---|---|---|---|---|
| WO-1993013102-A1 | DEAZAAMINOPTERINS | SOUTHERN RESEARCH INSTITUTE (US) | 1993-07-08 | — | — | WO | disclosed |
| US-5077404-A | Cyclized 5,10-dideazaaminopterin compounds | SRI INTERNATIONAL | 1991-12-31 | — | — | US | disclosed |