Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 6/20 | 0.61 |
| ▸ | CA2 | P00918 | 6/20 | 0.61 |
| ▸ | DHFR | P00374 | 6/20 | 0.55 |
| ▸ | CA9 | Q16790 | 3/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.44 |
| ▸ | TLR4 | O00206 | 1/20 | 0.44 |
| ▸ | MEN1 | O00255 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.44 |
| ▸ | TP53 | P04637 | 1/20 | 0.44 |
| ▸ | TYMS | P04818 | 1/20 | 0.44 |
| ▸ | GLA | P06280 | 1/20 | 0.44 |
| ▸ | POLB | P06746 | 1/20 | 0.44 |
| ▸ | HMGB1 | P09429 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 1/20 | 0.44 |
| ▸ | FOLR2 | P14207 | 1/20 | 0.44 |
| ▸ | FOLR1 | P15328 | 1/20 | 0.44 |
| ▸ | HPGD | P15428 | 1/20 | 0.44 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.44 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL5861648 | 0.88 | DHFR (0.57) | DHFR | |
| SCHEMBL4685928 | 0.76 | DHFR (0.61) | DHFRKDM4ETLR4MEN1ALDH1A1 | |
| SCHEMBL13187327 | 0.76 | CA1 (1.00) | CA1CA2DHFRCA9 | |
| SCHEMBL13583145 | 0.74 | CA1 (0.55) | CA1CA2DHFRCA9 | |
| SCHEMBL11664759 | 0.74 | DHFR (0.78) | DHFR | |
| SCHEMBL480695 | 0.72 | CA1 (0.48) | CA1CA2DHFRCA9 | |
| SCHEMBL7242695 | 0.71 | NCOA3 (0.58) | CA1CA2DHFRCA9KDM4E | |
| SCHEMBL29658170 | 0.70 | DHFR (0.71) | CA1CA2DHFRCA9KDM4E | |
| SCHEMBL221621 | 0.70 | DHFR (0.71) | CA1CA2DHFRCA9KDM4E | |
| SCHEMBL14100003 | 0.70 | DHFR (0.62) | CA1CA2DHFRCA9KDM4E |
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 |
|---|---|---|---|---|---|---|---|
| EP-2410856-A1 | DIAMINOPTERIDINE DERIVATIVES | Biorelix, Inc. (US) | 2012-02-01 | — | — | EP | disclosed |
| WO-2010110907-A1 | DIAMINOPTERIDINE DERIVATIVES | BIORELIX, INC. (US) | 2010-09-30 | — | — | WO | disclosed |