Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 5/20 | 0.70 |
| ▸ | ACHE | P22303 | 2/20 | 0.70 |
| ▸ | MEN1 | O00255 | 4/20 | 0.59 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.59 |
| ▸ | HPGD | P15428 | 2/20 | 0.59 |
| ▸ | PTPN1 | P18031 | 3/20 | 0.57 |
| ▸ | PTPN11 | Q06124 | 2/20 | 0.57 |
| ▸ | FASN | P49327 | 1/20 | 0.56 |
| ▸ | CA12 | O43570 | 3/20 | 0.55 |
| ▸ | CA1 | P00915 | 3/20 | 0.55 |
| ▸ | CA2 | P00918 | 3/20 | 0.55 |
| ▸ | CA7 | P43166 | 3/20 | 0.55 |
| ▸ | CA9 | Q16790 | 3/20 | 0.55 |
| ▸ | CA14 | Q9ULX7 | 3/20 | 0.55 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.52 |
| ▸ | DRD3 | P35462 | 1/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.50 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.50 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.50 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL180437 | 1.00 | CYP3A4 (0.70) | CYP3A4ACHEMEN1KMT2AHPGD | |
| Benzene SCHEMBL28591583 | 0.97 | CYP3A4 (0.67) | CYP3A4ACHEMEN1KMT2AHPGD | |
| Water SCHEMBL1285656 | 0.97 | CYP3A4 (0.67) | CYP3A4ACHEMEN1KMT2AHPGD | |
| SCHEMBL8215504 | 0.97 | CYP3A4 (0.67) | CYP3A4ACHEMEN1KMT2AHPGD | |
| SCHEMBL8206510 | 0.97 | CYP3A4 (0.67) | CYP3A4ACHEMEN1KMT2AHPGD | |
| Methane SCHEMBL28043126 | 0.97 | CYP3A4 (0.67) | CYP3A4ACHEMEN1KMT2AHPGD | |
| Ethylene Glycol SCHEMBL7777088 | 0.90 | CYP3A4 (0.59) | CYP3A4ACHEMEN1KMT2AHPGD | |
| Propene SCHEMBL28630654 | 0.86 | CYP3A4 (0.61) | CYP3A4ACHEMEN1KMT2AHPGD | |
| SCHEMBL2127547 | 0.85 | CYP3A4 (0.59) | CYP3A4ACHEMEN1KMT2AHPGD | |
| SCHEMBL29419953 | 0.85 | CYP3A4 (0.59) | CYP3A4ACHEMEN1KMT2AHPGD |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7183269-B2 | Synergistic compositions for the selective control of tumor tissue | KREUTZ WERNER | 2007-02-27 | — | — | US | disclosed |
| US-20040147493-A1 | Synergistic compositions for the selective control of tumor tissue | KREUTZ WERNER | 2004-07-29 | — | — | US | disclosed |
| US-6727235-B2 | Synergistic mixture comprising benzoic acid derivatives for use as anticarcinogenic agents, antitumor agents | KREUTZ WERNER (DE) | 2004-04-27 | — | — | US | disclosed |
| US-20030166621-A1 | Synergistic mixture comprising benzoic acid derivatives for use as anticarcinogenic agents, antitumor agents | KREUTZ WERNER (DE) | 2003-09-04 | — | — | US | disclosed |