Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | XDH | P47989 | 1/20 | 0.54 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.49 |
| ▸ | HPGD | P15428 | 2/20 | 0.49 |
| ▸ | AR | P10275 | 2/20 | 0.49 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.49 |
| ▸ | LMNA | P02545 | 1/20 | 0.49 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.49 |
| ▸ | PGR | P06401 | 1/20 | 0.49 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.49 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.49 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.49 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.49 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.49 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.49 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.49 |
| ▸ | MEN1 | O00255 | 4/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.49 |
| ▸ | GABRA1 | P14867 | 3/20 | 0.49 |
| ▸ | GABRB2 | P47870 | 3/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL680148 | 0.92 | XDH (0.63) | XDHCYP3A4HPGDARCYP1A2 | |
| SCHEMBL9495776 | 0.86 | MEN1 (0.57) | XDHCYP3A4HPGDARLMNA | |
| SCHEMBL977495 | 0.80 | XDH (0.61) | XDHCYP3A4HPGDARMEN1 | |
| SCHEMBL526114 | 0.80 | TDP1 (0.52) | XDHCYP3A4HPGDARALOX15 | |
| SCHEMBL11244618 | 0.79 | GSTA1 (0.45) | CYP3A4HPGDARALOX15LMNA | |
| SCHEMBL9246348 | 0.79 | XDH (0.59) | XDHCYP3A4HPGDARMEN1 | |
| SCHEMBL5831660 | 0.79 | XDH (0.59) | XDHCYP3A4HPGDARCYP1A2 | |
| Zinc Ion SCHEMBL9246345 | 0.78 | XDH (0.58) | XDHCYP3A4HPGDARMEN1 | |
| Chavicol SCHEMBL11490954 | 0.75 | ALDH1A1 (0.56) | XDHCYP3A4HPGDALOX15LMNA | |
| Salicylic Acid SCHEMBL3435070 | 0.74 | ALDH1A1 (0.60) | XDHCYP3A4HPGDALOX15LMNA |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4177122-A | ETHERIFICATION WITH AN ALKYLENE OXIDE FOLLOWED BY ESTERIFICATION WITH AN UNSATURATED CARBOXYLIC ACID | TOYO INK MANUFACTURING CO., LTD. (JP) | 1979-12-04 | — | — | US | claimed |
| US-4177122-A | ETHERIFICATION WITH AN ALKYLENE OXIDE FOLLOWED BY ESTERIFICATION WITH AN UNSATURATED CARBOXYLIC ACID | TOYO INK MANUFACTURING CO., LTD. (JP) | 1979-12-04 | — | — | US | disclosed |