Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BCHE | P06276 | 13/20 | 0.62 |
| ▸ | ACHE | P22303 | 12/20 | 0.62 |
| ▸ | BACE1 | P56817 | 12/20 | 0.62 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.53 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.51 |
| ▸ | HTT | P42858 | 1/20 | 0.51 |
| ▸ | CCR3 | P51677 | 1/20 | 0.51 |
| ▸ | DRD2 | P14416 | 2/20 | 0.50 |
| ▸ | DRD4 | P21917 | 1/20 | 0.50 |
| ▸ | HTR2A | P28223 | 1/20 | 0.50 |
| ▸ | DRD3 | P35462 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL1022187 | 0.78 | SIGMAR1 (0.60) | SIGMAR1ALDH1A1HTTCCR3DRD2 | |
| SCHEMBL22361722 | 0.78 | CARM1 (0.49) | BCHEACHEBACE1CCR3 | |
| SCHEMBL8311629 | 0.77 | BCHE (0.67) | BCHEACHEBACE1SIGMAR1 | |
| SCHEMBL17967858 | 0.77 | ALDH1A1 (0.57) | SIGMAR1ALDH1A1HTTDRD2DRD4 | |
| SCHEMBL8313501 | 0.76 | BCHE (0.56) | BCHEACHEBACE1 | |
| Hydrochloric Acid SCHEMBL1239207 | 0.75 | ALDH1A1 (0.55) | SIGMAR1ALDH1A1HTTDRD2DRD4 | |
| Hydrochloric Acid SCHEMBL1237435 | 0.75 | ALDH1A1 (0.55) | SIGMAR1ALDH1A1HTTDRD2DRD4 | |
| SCHEMBL4131291 | 0.75 | ACHE (1.00) | BCHEACHEBACE1 | |
| SCHEMBL5692288 | 0.75 | ACHE (1.00) | BCHEACHEBACE1 | |
| SCHEMBL4635732 | 0.75 | ACHE (0.75) | BCHEACHEBACE1SIGMAR1CCR3 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0787716-B1 | Isoprene derivatives | NISSHIN FLOUR MILLING CO (JP) | 1999-12-08 | — | — | EP | disclosed |
| US-5756475-A | POLYISOPRENE MODIFIED WITH AMINE WITH ANTICANCER AGENTS | NISSHIN FLOUR MILLING CO., LTD. (JP) | 1998-05-26 | — | — | US | disclosed |
| EP-0787716-A1 | Isoprene derivatives | NISSHIN FLOUR MILLING CO., LTD. (JP) | 1997-08-06 | — | — | EP | disclosed |