Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.51 |
| ▸ | PARP1 | P09874 | 8/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 4/20 | 0.39 |
| ▸ | RECQL | P46063 | 2/20 | 0.39 |
| ▸ | JAK2 | O60674 | 1/20 | 0.38 |
| ▸ | RPS6KA3 | P51812 | 1/20 | 0.38 |
| ▸ | MELK | Q14680 | 1/20 | 0.38 |
| ▸ | STK24 | Q9Y6E0 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 2/20 | 0.35 |
| ▸ | USP2 | O75604 | 2/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.35 |
| ▸ | ATM | Q13315 | 1/20 | 0.35 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.35 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.35 |
| ▸ | TYMS | P04818 | 2/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.34 |
| ▸ | POLB | P06746 | 2/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL2231071 | 0.78 | ALDH1A1 (0.53) | ALDH1A1PARP1TDP1RECQLJAK2 | |
| SCHEMBL2229183 | 0.78 | ALDH1A1 (0.53) | ALDH1A1PARP1TDP1RECQLJAK2 | |
| SCHEMBL2228710 | 0.78 | ALDH1A1 (0.53) | ALDH1A1PARP1TDP1RECQLJAK2 | |
| SCHEMBL2229176 | 0.78 | ALDH1A1 (0.53) | ALDH1A1PARP1TDP1RECQLJAK2 | |
| SCHEMBL2229693 | 0.78 | KDM4E (0.58) | ALDH1A1PARP1TDP1RECQLJAK2 | |
| SCHEMBL2229401 | 0.78 | ALDH1A1 (0.53) | ALDH1A1PARP1TDP1RECQLJAK2 | |
| SCHEMBL2231860 | 0.75 | ALDH1A1 (0.50) | ALDH1A1PARP1TDP1RECQLJAK2 | |
| SCHEMBL2229404 | 0.74 | ALDH1A1 (0.49) | ALDH1A1PARP1TDP1RECQLJAK2 | |
| SCHEMBL2353924 | 0.74 | ALDH1A1 (0.49) | ALDH1A1PARP1TDP1RECQLJAK2 | |
| SCHEMBL2228806 | 0.74 | ALDH1A1 (0.49) | ALDH1A1PARP1TDP1RECQLJAK2 |
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-2015047134-A1 | BIS(5-AMINO-1,4-DIOXO-1,2,3,4-TETRAHYDROPHTHALAZINE-2-YL) ZINC FOR TREATING DAMAGED CUTANEOUS AND MUCOUS SURFACES | Общество с ограниченной ответственностью "Сэлвим" | 2015-04-02 | — | — | WO | disclosed |
| WO-2015047134-A1 | BIS(5-AMINO-1,4-DIOXO-1,2,3,4-TETRAHYDROPHTHALAZINE-2-YL) ZINC FOR TREATING DAMAGED CUTANEOUS AND MUCOUS SURFACES | Общество с ограниченной ответственностью "Сэлвим" | 2015-04-02 | — | — | WO | disclosed |