Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 3/20 | 0.43 |
| ▸ | EBP | Q15125 | 2/20 | 0.43 |
| ▸ | SLC6A4 | P31645 | 6/20 | 0.38 |
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.38 |
| ▸ | SLC6A9 | P48067 | 2/20 | 0.36 |
| ▸ | AR | P10275 | 4/20 | 0.36 |
| ▸ | ACP3 | P15309 | 1/20 | 0.35 |
| ▸ | SLC6A2 | P23975 | 5/20 | 0.35 |
| ▸ | MEN1 | O00255 | 4/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.35 |
| ▸ | LMNA | P02545 | 4/20 | 0.35 |
| ▸ | SLC6A3 | Q01959 | 4/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.35 |
| ▸ | NPC1 | O15118 | 2/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.35 |
| ▸ | MTOR | P42345 | 2/20 | 0.35 |
| ▸ | RAB9A | P51151 | 2/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.35 |
| ▸ | KCNK2 | O95069 | 2/20 | 0.35 |
| ▸ | HTR2C | P28335 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL7968557 | 0.90 | EBP (0.43) | SIGMAR1EBPSLC6A4ARMEN1 | |
| SCHEMBL7972074 | 0.90 | SIGMAR1 (0.46) | SIGMAR1EBPSLC6A4HRH3SLC6A9 | |
| SCHEMBL7969031 | 0.88 | EBP (0.43) | SIGMAR1EBPMEN1KMT2ALMNA | |
| SCHEMBL7966011 | 0.88 | EBP (0.43) | SIGMAR1EBPSLC6A4MEN1KMT2A | |
| SCHEMBL7966573 | 0.87 | SIGMAR1 (0.41) | SIGMAR1EBPSLC6A4HRH3SLC6A9 | |
| SCHEMBL7965756 | 0.82 | EBP (0.43) | SIGMAR1EBPSLC6A4HRH3SLC6A9 | |
| SCHEMBL7966973 | 0.82 | SIGMAR1 (0.47) | SIGMAR1EBPSLC6A4SLC6A2MEN1 | |
| SCHEMBL7965251 | 0.82 | EBP (0.53) | SIGMAR1EBPSLC6A4HRH3SLC6A9 | |
| SCHEMBL7971754 | 0.81 | EBP (0.55) | SIGMAR1EBPSLC6A4HRH3SLC6A9 | |
| SCHEMBL7965746 | 0.81 | SIGMAR1 (0.49) | SIGMAR1EBPSLC6A4SLC6A2MEN1 |
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-6265439-B1 | Halogenated phenylacetonitrile alkylaminoalkylphenyl compounds as immunosuppressives | G.D. SEARLE & CO. | 2001-07-24 | — | — | US | disclosed |
| US-5451604-A | Useful in organ transplant surgery | G. D. SEARLE & CO. (US) | 1995-09-19 | — | — | US | disclosed |