Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 7/20 | 0.63 |
| ▸ | TSHR | P16473 | 1/20 | 0.63 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.58 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.58 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.58 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.58 |
| ▸ | RAB9A | P51151 | 8/20 | 0.56 |
| ▸ | NPC1 | O15118 | 6/20 | 0.56 |
| ▸ | LMNA | P02545 | 3/20 | 0.54 |
| ▸ | MAPT | P10636 | 4/20 | 0.53 |
| ▸ | TP53 | P04637 | 1/20 | 0.53 |
| ▸ | XBP1 | P17861 | 1/20 | 0.53 |
| ▸ | HTT | P42858 | 1/20 | 0.53 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.53 |
| ▸ | FOLH1 | Q04609 | 3/20 | 0.53 |
| ▸ | PRKCA | P17252 | 1/20 | 0.52 |
| ▸ | PRKCD | Q05655 | 1/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.51 |
| ▸ | HPGD | P15428 | 2/20 | 0.51 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL15012759 | 0.91 | TDP1 (0.71) | SMN1; SMN2TSHRKMT2ATDP1SLC6A2 | |
| SCHEMBL181934 | 0.83 | TDP1 (0.73) | SMN1; SMN2KMT2ATDP1SLC6A2SLC6A3 | |
| SCHEMBL6274205 | 0.82 | KMT2A (0.79) | SMN1; SMN2KMT2ATDP1SLC6A2SLC6A3 | |
| SCHEMBL6001726 | 0.82 | KMT2A (0.58) | SMN1; SMN2TSHRKMT2ATDP1SLC6A2 | |
| SCHEMBL6530665 | 0.82 | RAB9A (0.56) | SMN1; SMN2TSHRKMT2ATDP1SLC6A2 | |
| SCHEMBL1482628 | 0.81 | KMT2A (0.76) | SMN1; SMN2TSHRKMT2ATDP1SLC6A2 | |
| SCHEMBL419555 | 0.81 | KMT2A (0.81) | SMN1; SMN2KMT2ATDP1SLC6A2SLC6A3 | |
| Benzyl Benzoate SCHEMBL8359694 | 0.81 | KMT2A (0.89) | SMN1; SMN2TSHRKMT2ATDP1SLC6A2 | |
| SCHEMBL312910 | 0.81 | TDP1 (0.81) | SMN1; SMN2KMT2ATDP1SLC6A2SLC6A3 | |
| SCHEMBL11777793 | 0.81 | KMT2A (0.74) | SMN1; SMN2TSHRKMT2ATDP1SLC6A2 |
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-1485470-A2 | USE OF XYLENE MONOOXYGENASE FOR THE OXIDATION OF SUBSTITUTED MONOCYCLIC AROMATIC COMPOUNDS | E.I. DU PONT DE NEMOURS AND COMPANY (US) | 2004-12-15 | — | — | EP | disclosed |
| US-20030073206-A1 | Use of xylene monooxygenase for the oxidation of substituted monocyclic aromatic compounds | E. I. DU PONT DE NEMOURS AND COMPANY | 2003-04-17 | — | — | US | disclosed |
| WO-2003014368-A2 | USE OF XYLENE MONOOXYGENASE FOR THE OXIDATION OF SUBSTITUTED MONOCYCLIC AROMATIC COMPOUNDS | E.I. DU PONT DE NEMOURS AND COMPANY (US) | 2003-02-20 | — | — | WO | disclosed |