Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 4/20 | 0.56 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.56 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.56 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.56 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.56 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.56 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.56 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.50 |
| ▸ | MAPT | P10636 | 2/20 | 0.50 |
| ▸ | LMNA | P02545 | 1/20 | 0.50 |
| ▸ | HTT | P42858 | 1/20 | 0.50 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.48 |
| ▸ | POLB | P06746 | 3/20 | 0.47 |
| ▸ | APEX1 | P27695 | 2/20 | 0.47 |
| ▸ | RECQL | P46063 | 1/20 | 0.47 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.45 |
| ▸ | STAT6 | P42226 | 1/20 | 0.45 |
| ▸ | HPGD | P15428 | 4/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL29352673 | 0.87 | CYP1A2 (0.73) | CYP1A2CYP2D6CYP2C19CYP3A4MAPK1 | |
| SCHEMBL8887013 | 0.87 | CYP1A2 (0.73) | CYP1A2CYP2D6CYP2C19CYP3A4MAPK1 | |
| SCHEMBL54175 | 0.87 | CYP1A2 (0.73) | CYP1A2CYP2D6CYP2C19CYP3A4MAPK1 | |
| Thiocyanic Acid SCHEMBL8734334 | 0.83 | CYP1A2 (0.67) | CYP1A2CYP2D6CYP2C19CYP3A4MAPK1 | |
| Urea SCHEMBL28131099 | 0.83 | CYP1A2 (0.61) | CYP1A2CYP2D6CYP2C19CYP3A4MAPK1 | |
| Dimethylamine SCHEMBL8652976 | 0.82 | CYP1A2 (0.65) | CYP1A2CYP2D6CYP2C19CYP3A4MAPK1 | |
| 2-Mercaptobenzothiazole SCHEMBL8153954 | 0.80 | CYP1A2 (0.61) | CYP1A2CYP2D6CYP2C19CYP3A4MAPK1 | |
| Glutaral SCHEMBL9224584 | 0.80 | CYP1A2 (0.57) | CYP1A2CYP2D6CYP2C19CYP3A4MAPK1 | |
| SCHEMBL29729525 | 0.77 | APEX1 (0.51) | CYP1A2CYP2D6CYP2C19CYP3A4MAPK1 | |
| Di(Hydroxyethyl)Ether SCHEMBL9867190 | 0.77 | CYP1A2 (0.57) | CYP1A2CYP2D6CYP2C19CYP3A4MAPK1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1517859-A4 | TREATING MICRO-ORGANISMS IN WATER USING BORON CONDITIONED ENZYMES | NOVAPHARM RES AUSTRALIA (AU) | 2009-06-17 | — | — | EP | disclosed |
| EP-1517859-A1 | TREATING MICRO-ORGANISMS IN WATER USING BORON CONDITIONED ENZYMES | NOVAPHARM RESEARCH (AUSTRALIA) PTY. LIMITED (AU) | 2005-03-30 | — | — | EP | disclosed |
| WO-2004002896-A1 | TREATING MICRO-ORGANISMS IN WATER USING BORON CONDITIONED ENZYMES | NOVAPHARM RESEARCH (AUSTRALIA) PTY LTD (AU) | 2004-01-08 | — | — | WO | disclosed |