Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.46 |
| ▸ | ITGB2 | P05107 | 1/20 | 0.43 |
| ▸ | ICAM1 | P05362 | 1/20 | 0.43 |
| ▸ | ITGAL | P20701 | 1/20 | 0.43 |
| ▸ | CTRC | Q99895 | 1/20 | 0.43 |
| ▸ | CFTR | P13569 | 1/20 | 0.42 |
| ▸ | GOPC | Q9HD26 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 5/20 | 0.42 |
| ▸ | HTT | P42858 | 4/20 | 0.42 |
| ▸ | MAPT | P10636 | 3/20 | 0.42 |
| ▸ | MEN1 | O00255 | 3/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.41 |
| ▸ | POLB | P06746 | 2/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.40 |
| ▸ | APAF1 | O14727 | 1/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | THRB | P10828 | 1/20 | 0.40 |
| ▸ | XBP1 | P17861 | 1/20 | 0.40 |
| ▸ | PTBP1 | P26599 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| Benzene SCHEMBL11037142 | 0.86 | ITGB2 (0.40) | ALDH1A1KMT2AITGB2ICAM1ITGAL | |
| Toluene SCHEMBL6404501 | 0.80 | LMNA (0.52) | ALDH1A1KMT2AITGB2ICAM1ITGAL | |
| Phenol SCHEMBL29008157 | 0.80 | TDP1 (0.52) | ALDH1A1KMT2AITGB2ICAM1ITGAL | |
| Phenol SCHEMBL27865185 | 0.80 | TDP1 (0.52) | ALDH1A1KMT2AITGB2ICAM1ITGAL | |
| O-Xylene SCHEMBL29032311 | 0.77 | TSHR (0.50) | ALDH1A1KMT2AITGB2ICAM1ITGAL | |
| SCHEMBL1332032 | 0.76 | — | — | |
| SCHEMBL13629 | 0.76 | — | — | |
| SCHEMBL1332336 | 0.76 | — | — | |
| SCHEMBL20546841 | 0.76 | ALDH1A1 (0.47) | ALDH1A1ITGB2ICAM1ITGALLMNA | |
| SCHEMBL2011229 | 0.76 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-105377807-A | Fluorinated carbonates comprising double bond-containing groups, methods for their manufacture and uses thereof | SOLVAY | 2016-03-02 | — | — | CN | disclosed |