Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EBP | Q15125 | 2/20 | 0.43 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.43 |
| ▸ | AR | P10275 | 4/20 | 0.38 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.38 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.38 |
| ▸ | SLC6A9 | P48067 | 8/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.35 |
| ▸ | PGR | P06401 | 1/20 | 0.35 |
| ▸ | TACR1 | P25103 | 1/20 | 0.33 |
| ▸ | ACP3 | P15309 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | TP53 | P04637 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL7968647 | 0.91 | EBP (0.43) | EBPSIGMAR1ARSLC6A4SLC6A9 | |
| SCHEMBL7966573 | 0.91 | SIGMAR1 (0.41) | EBPSIGMAR1ARSLC6A4HRH3 | |
| SCHEMBL7971946 | 0.89 | EBP (0.43) | EBPSIGMAR1ARSLC6A4CYP3A4 | |
| SCHEMBL7965668 | 0.89 | EBP (0.43) | EBPSIGMAR1ARSLC6A4CYP3A4 | |
| SCHEMBL7972074 | 0.87 | SIGMAR1 (0.46) | EBPSIGMAR1ARSLC6A4HRH3 | |
| SCHEMBL7971287 | 0.86 | AR (0.39) | EBPSIGMAR1ARSLC6A4CYP3A4 | |
| SCHEMBL7968651 | 0.86 | EBP (0.39) | EBPSIGMAR1ARSLC6A4CYP3A4 | |
| SCHEMBL7969252 | 0.84 | SIGMAR1 (0.47) | EBPSIGMAR1SLC6A4CYP3A4CYP2D6 | |
| SCHEMBL7966651 | 0.84 | EBP (0.39) | EBPSIGMAR1ARSLC6A4CYP3A4 | |
| SCHEMBL7965708 | 0.84 | EBP (0.39) | EBPSIGMAR1SLC6A4SLC6A9CYP3A4 |
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-6265439-B1 | Halogenated phenylacetonitrile alkylaminoalkylphenyl compounds as immunosuppressives | G.D. SEARLE & CO. | 2001-07-24 | — | — | US | disclosed |