Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 3/20 | 0.46 |
| ▸ | EBP | Q15125 | 2/20 | 0.46 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.40 |
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.40 |
| ▸ | SLC6A9 | P48067 | 7/20 | 0.38 |
| ▸ | AR | P10275 | 4/20 | 0.38 |
| ▸ | PGR | P06401 | 1/20 | 0.37 |
| ▸ | ACP3 | P15309 | 1/20 | 0.35 |
| ▸ | TACR1 | P25103 | 2/20 | 0.35 |
| ▸ | NPC1 | O15118 | 2/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.35 |
| ▸ | MTOR | P42345 | 2/20 | 0.35 |
| ▸ | RAB9A | P51151 | 2/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | TP53 | P04637 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL7971875 | 0.90 | SIGMAR1 (0.43) | SIGMAR1EBPSLC6A4HRH3SLC6A9 | |
| SCHEMBL7968642 | 0.90 | EBP (0.46) | SIGMAR1EBPSLC6A4ARPGR | |
| SCHEMBL7968615 | 0.88 | EBP (0.46) | SIGMAR1EBPSLC6A4CYP2D6CYP2C19 | |
| SCHEMBL7968950 | 0.88 | EBP (0.46) | SIGMAR1EBPSLC6A4CYP2D6CYP2C19 | |
| SCHEMBL7965756 | 0.87 | EBP (0.43) | SIGMAR1EBPSLC6A4HRH3SLC6A9 | |
| SCHEMBL7972161 | 0.85 | AR (0.41) | SIGMAR1EBPARPGRACP3 | |
| SCHEMBL7972558 | 0.85 | EBP (0.41) | SIGMAR1EBPSLC6A4ARPGR | |
| SCHEMBL7965746 | 0.83 | SIGMAR1 (0.49) | SIGMAR1EBPSLC6A4CYP2D6CYP2C19 | |
| SCHEMBL7971754 | 0.83 | EBP (0.55) | SIGMAR1EBPSLC6A4HRH3SLC6A9 | |
| SCHEMBL7966573 | 0.82 | SIGMAR1 (0.41) | SIGMAR1EBPSLC6A4HRH3SLC6A9 |
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 |