Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TGFBR1 | P36897 | 3/20 | 0.39 |
| ▸ | FOLH1 | Q04609 | 4/20 | 0.35 |
| ▸ | NAALAD2 | Q9Y3Q0 | 3/20 | 0.35 |
| ▸ | RIMKLA | Q8IXN7 | 1/20 | 0.35 |
| ▸ | MME | P08473 | 1/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
| ▸ | THRB | P10828 | 1/20 | 0.31 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.31 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.31 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.31 |
| ▸ | THPO | P40225 | 1/20 | 0.31 |
| ▸ | RECQL | P46063 | 1/20 | 0.31 |
| ▸ | BLM | P54132 | 1/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.31 |
| ▸ | ACE | P12821 | 1/20 | 0.31 |
| ▸ | GGH | Q92820 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 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 | |
|---|---|---|---|---|
| SCHEMBL218863 | 0.79 | FOLH1 (0.39) | TGFBR1FOLH1NAALAD2RIMKLAMME | |
| SCHEMBL25761614 | 0.79 | ALDH1A1 (0.39) | TGFBR1FOLH1NAALAD2RIMKLAMME | |
| SCHEMBL20943649 | 0.79 | FOLH1 (0.59) | FOLH1NAALAD2RIMKLAGGH | |
| SCHEMBL16750035 | 0.79 | ALDH1A1 (0.39) | TGFBR1FOLH1NAALAD2RIMKLAMME | |
| SCHEMBL465452 | 0.79 | ALDH1A1 (0.39) | TGFBR1FOLH1NAALAD2RIMKLAMME | |
| SCHEMBL5729609 | 0.79 | FOLH1 (0.39) | TGFBR1FOLH1NAALAD2RIMKLAMME | |
| SCHEMBL57052 | 0.76 | — | — | |
| SCHEMBL1775718 | 0.76 | — | — | |
| SCHEMBL1830619 | 0.76 | — | — | |
| SCHEMBL20988212 | 0.76 | TGFBR1 (0.35) | TGFBR1FOLH1NAALAD2RIMKLAMME |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20180079660-A1 | PROCESS AND MATERIAL FOR REMOVAL OF NITROSAMINES FROM AQUEOUS SYSTEMS | UNIVERSITY OF KENTUCKY RESEARCH FOUNDATION | 2018-03-22 | — | — | US | disclosed |