Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 4/20 | 0.46 |
| ▸ | EBP | Q15125 | 2/20 | 0.46 |
| ▸ | BCHE | P06276 | 2/20 | 0.43 |
| ▸ | UBE2M | P61081 | 2/20 | 0.36 |
| ▸ | DCUN1D1 | Q96GG9 | 2/20 | 0.36 |
| ▸ | MTOR | P42345 | 1/20 | 0.36 |
| ▸ | PTGES | O14684 | 1/20 | 0.36 |
| ▸ | TMEM97 | Q5BJF2 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.34 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.34 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.33 |
| ▸ | GPBAR1 | Q8TDU6 | 1/20 | 0.33 |
| ▸ | SLC6A9 | P48067 | 1/20 | 0.33 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.33 |
| ▸ | NR1H3 | Q13133 | 1/20 | 0.33 |
| ▸ | SLC22A2 | O15244 | 1/20 | 0.33 |
| ▸ | SLC22A1 | O15245 | 1/20 | 0.33 |
| ▸ | SLC22A3 | O75751 | 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 | |
|---|---|---|---|---|
| SCHEMBL7966973 | 0.92 | SIGMAR1 (0.47) | SIGMAR1EBPUBE2MDCUN1D1MTOR | |
| SCHEMBL7968643 | 0.92 | SIGMAR1 (0.46) | SIGMAR1EBPBCHETMEM97SMN1; SMN2 | |
| SCHEMBL7965705 | 0.91 | SIGMAR1 (0.45) | SIGMAR1EBPBCHEUBE2MDCUN1D1 | |
| SCHEMBL7958075 | 0.90 | SIGMAR1 (0.44) | SIGMAR1EBPBCHEUBE2MDCUN1D1 | |
| SCHEMBL7974380 | 0.89 | SIGMAR1 (0.46) | SIGMAR1EBPBCHEUBE2MDCUN1D1 | |
| SCHEMBL7973583 | 0.89 | SIGMAR1 (0.46) | SIGMAR1EBPBCHEUBE2MDCUN1D1 | |
| SCHEMBL7974383 | 0.89 | SIGMAR1 (0.40) | SIGMAR1EBPBCHEUBE2MDCUN1D1 | |
| SCHEMBL7957822 | 0.87 | BCHE (0.43) | SIGMAR1EBPBCHEUBE2MDCUN1D1 | |
| SCHEMBL7968393 | 0.87 | SIGMAR1 (0.41) | SIGMAR1EBPBCHEUBE2MDCUN1D1 | |
| SCHEMBL7971879 | 0.86 | SIGMAR1 (0.57) | SIGMAR1EBPPTGESSMN1; SMN2LMNA |
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 |