Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TP53 | P04637 | 1/20 | 0.38 |
| ▸ | NR1H2 | P55055 | 2/20 | 0.36 |
| ▸ | NR1H3 | Q13133 | 2/20 | 0.36 |
| ▸ | CYP19A1 | P11511 | 2/20 | 0.31 |
| ▸ | CALM1 | P0DP23 | 1/20 | 0.31 |
| ▸ | TSHR | P16473 | 2/20 | 0.30 |
| ▸ | IDO1 | P14902 | 1/20 | 0.30 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.30 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.30 |
| ▸ | ELANE | P08246 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL115193 | 0.85 | TP53 (0.38) | TP53CYP19A1TSHRALDH1A1KDM4E | |
| SCHEMBL242725 | 0.81 | CALM1 (0.45) | TP53NR1H2NR1H3CYP19A1CALM1 | |
| Naphthalene SCHEMBL28055828 | 0.79 | CYP2A6 (0.36) | TP53ALDH1A1KDM4E | |
| SCHEMBL22689574 | 0.79 | CALM1 (0.39) | TP53NR1H2NR1H3CYP19A1CALM1 | |
| SCHEMBL11128894 | 0.78 | ESR1 (0.34) | TP53 | |
| Diphenylamine SCHEMBL7525400 | 0.74 | HSD17B10 (0.48) | TSHRALDH1A1KDM4ENPSR1 | |
| SCHEMBL11200862 | 0.74 | KIF11 (0.41) | ALDH1A1KDM4E | |
| Isopropyl Alcohol SCHEMBL27835014 | 0.74 | TRPA1 (0.42) | TP53NR1H2NR1H3TSHRALDH1A1 | |
| SCHEMBL707866 | 0.73 | ESR1 (0.40) | NR1H2NR1H3 | |
| SCHEMBL15302213 | 0.73 | TP53 (0.46) | TP53CYP19A1CALM1TSHRIDO1 |
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 |
|---|---|---|---|---|---|---|---|
| US-6706398-B1 | FORMING HIGHER HYDROPHOBICITY FILLERS; SURFACE TREATMENT WITH COMBINATION OF MONOMERIC DICHLOROSILANES AND TRIALKOXYSILANES | DOW CORNING CORPORATION | 2004-03-16 | — | — | US | claimed |