Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRA2A | P08913 | 8/20 | 0.43 |
| ▸ | ADRA2C | P18825 | 8/20 | 0.43 |
| ▸ | ADRA2B | P18089 | 7/20 | 0.43 |
| ▸ | DRD2 | P14416 | 1/20 | 0.43 |
| ▸ | DRD4 | P21917 | 1/20 | 0.43 |
| ▸ | DRD3 | P35462 | 1/20 | 0.43 |
| ▸ | NPY5R | Q15761 | 2/20 | 0.40 |
| ▸ | PIN1 | Q13526 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | HPGDS | O60760 | 1/20 | 0.37 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.36 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.36 |
| ▸ | SMO | Q99835 | 2/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL8964029 | 0.82 | DRD4 (0.44) | DRD2DRD4DRD3NPY5RHPGDS | |
| SCHEMBL8963851 | 0.75 | DRD3 (0.36) | ADRA2AADRA2CADRA2BDRD2DRD4 | |
| SCHEMBL19995433 | 0.72 | KIT (0.37) | ALDH1A1MAPT | |
| SCHEMBL20012191 | 0.72 | KIT (0.37) | ALDH1A1MAPT | |
| SCHEMBL8964228 | 0.70 | TP53 (0.36) | PIN1SMOMAPT | |
| SCHEMBL3567530 | 0.69 | ESR1 (0.52) | ADRA2AADRA2CADRA2BDRD2 | |
| SCHEMBL13380548 | 0.69 | ESR1 (0.52) | ADRA2AADRA2CADRA2BDRD2 | |
| SCHEMBL12662987 | 0.69 | ESR1 (0.52) | ADRA2AADRA2CADRA2BDRD2 | |
| Iodide SCHEMBL27708171 | 0.68 | ESR1 (0.51) | ADRA2AADRA2CADRA2BDRD2 | |
| SCHEMBL13999773 | 0.65 | ADRB1 (0.47) | ADRA2AADRA2CADRA2BALDH1A1KMT2A |
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-5514800-A | CALCIUM CHANNEL BLOCKERS, CEREBRAL ISCHEMIA | SYNTEX PHARMACEUTICALS, LTD. (GB) | 1996-05-07 | — | — | US | disclosed |