Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DHFR | P00374 | 12/20 | 1.00 |
| ▸ | FOLR1 | P15328 | 2/20 | 0.72 |
| ▸ | SLC19A1 | P41440 | 2/20 | 0.72 |
| ▸ | SLC46A1 | Q96NT5 | 2/20 | 0.72 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.72 |
| ▸ | TLR4 | O00206 | 1/20 | 0.72 |
| ▸ | MEN1 | O00255 | 1/20 | 0.72 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.72 |
| ▸ | LMNA | P02545 | 1/20 | 0.72 |
| ▸ | TP53 | P04637 | 1/20 | 0.72 |
| ▸ | TYMS | P04818 | 1/20 | 0.72 |
| ▸ | GLA | P06280 | 1/20 | 0.72 |
| ▸ | POLB | P06746 | 1/20 | 0.72 |
| ▸ | HMGB1 | P09429 | 1/20 | 0.72 |
| ▸ | MAPT | P10636 | 1/20 | 0.72 |
| ▸ | FOLR2 | P14207 | 1/20 | 0.72 |
| ▸ | HPGD | P15428 | 1/20 | 0.72 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.72 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.72 |
| ▸ | GART | P22102 | 1/20 | 0.72 |
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 | |
|---|---|---|---|---|
| SCHEMBL12918463 | 1.00 | DHFR (1.00) | DHFRFOLR1SLC19A1SLC46A1KDM4E | |
| SCHEMBL29430165 | 0.87 | DHFR (1.00) | DHFRFOLR1SLC19A1SLC46A1KDM4E | |
| SCHEMBL15700766 | 0.87 | DHFR (1.00) | DHFRFOLR1SLC19A1SLC46A1KDM4E | |
| SCHEMBL7081697 | 0.87 | DHFR (1.00) | DHFRFOLR1SLC19A1SLC46A1KDM4E | |
| Aminopterin SCHEMBL29398079 | 0.86 | DHFR (0.76) | DHFRFOLR1SLC19A1SLC46A1KDM4E | |
| Aminopterin SCHEMBL1626034 | 0.86 | DHFR (0.76) | DHFRFOLR1SLC19A1SLC46A1KDM4E | |
| Aminopterin SCHEMBL9514067 | 0.86 | DHFR (0.76) | DHFRFOLR1SLC19A1SLC46A1KDM4E | |
| Aminopterin SCHEMBL20769794 | 0.86 | DHFR (0.76) | DHFRFOLR1SLC19A1SLC46A1KDM4E | |
| Aminopterin SCHEMBL29443569 | 0.86 | DHFR (0.76) | DHFRFOLR1SLC19A1SLC46A1KDM4E | |
| Aminopterin SCHEMBL8161477 | 0.86 | DHFR (0.76) | DHFRFOLR1SLC19A1SLC46A1KDM4E |
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-4079056-A | REACTING 2,4-DIAMINO-6-PTERIDINE-METHANOL-HBR WITH TRIPHENYLPHOSPHINE DIBROMIDE OR PHOSPHORUS TRIBROMIDE | THE UNITED STATES OF AMERICA AS REPRESENTED BY THE DEPARTMENT OF HEALTH, EDUCATION AND WELFARE (US) | 1978-03-14 | — | — | US | disclosed |
| US-4077957-A | INTERMEDIATE FOR METHOTREXATE | THE UNITED STATES OF AMERICA AS REPRESENTED BY THE DEPARTMENT OF HEALTH, EDUCATION AND WELFARE (US) | 1978-03-07 | — | — | US | disclosed |