Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 6/20 | 0.46 |
| ▸ | EBP | Q15125 | 2/20 | 0.46 |
| ▸ | BCHE | P06276 | 2/20 | 0.43 |
| ▸ | TSHR | P16473 | 4/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.35 |
| ▸ | KCNH2 | Q12809 | 3/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | SLC22A1 | O15245 | 2/20 | 0.35 |
| ▸ | CHRM2 | P08172 | 2/20 | 0.35 |
| ▸ | HTR1A | P08908 | 2/20 | 0.35 |
| ▸ | ADRA2A | P08913 | 2/20 | 0.35 |
| ▸ | DRD2 | P14416 | 2/20 | 0.35 |
| ▸ | ADRA2B | P18089 | 2/20 | 0.35 |
| ▸ | ADRA2C | P18825 | 2/20 | 0.35 |
| ▸ | DRD1 | P21728 | 2/20 | 0.35 |
| ▸ | HTR2A | P28223 | 2/20 | 0.35 |
| ▸ | HTR2C | P28335 | 2/20 | 0.35 |
| ▸ | ADRA1A | P35348 | 2/20 | 0.35 |
| ▸ | OPRM1 | P35372 | 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 | |
|---|---|---|---|---|
| SCHEMBL7968625 | 0.92 | SIGMAR1 (0.47) | SIGMAR1EBPBCHETSHRSMN1; SMN2 | |
| SCHEMBL7956227 | 0.91 | SIGMAR1 (0.45) | SIGMAR1EBPBCHETSHRSMN1; SMN2 | |
| SCHEMBL7970875 | 0.90 | SIGMAR1 (0.44) | SIGMAR1EBPBCHETSHRSMN1; SMN2 | |
| SCHEMBL7968643 | 0.89 | SIGMAR1 (0.46) | SIGMAR1EBPBCHETSHRSMN1; SMN2 | |
| SCHEMBL7971672 | 0.89 | SIGMAR1 (0.46) | SIGMAR1EBPBCHETSHRSMN1; SMN2 | |
| SCHEMBL7973583 | 0.89 | SIGMAR1 (0.46) | SIGMAR1EBPBCHETSHRSMN1; SMN2 | |
| SCHEMBL7971807 | 0.89 | SIGMAR1 (0.41) | SIGMAR1EBPBCHETSHRSMN1; SMN2 | |
| SCHEMBL7968393 | 0.87 | SIGMAR1 (0.41) | SIGMAR1EBPBCHETSHRSMN1; SMN2 | |
| SCHEMBL7966013 | 0.86 | SIGMAR1 (0.57) | SIGMAR1EBPTSHRSMN1; SMN2CYP2C19 | |
| SCHEMBL7967723 | 0.85 | BCHE (0.43) | SIGMAR1EBPBCHETSHRSMN1; SMN2 |
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 |