Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC18A2 | Q05940 | 1/20 | 0.52 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.48 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.48 |
| ▸ | ACHE | P22303 | 1/20 | 0.44 |
| ▸ | TSHR | P16473 | 1/20 | 0.44 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.43 |
| ▸ | EGFR | P00533 | 1/20 | 0.42 |
| ▸ | POLB | P06746 | 1/20 | 0.42 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.42 |
| ▸ | HTR1A | P08908 | 1/20 | 0.42 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.42 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.42 |
| ▸ | DRD2 | P14416 | 1/20 | 0.42 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.42 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.42 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.42 |
| ▸ | DRD1 | P21728 | 1/20 | 0.42 |
| ▸ | HTR2A | P28223 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL7328216 | 0.99 | SLC18A2 (0.51) | SLC18A2SLC6A2SLC6A4ACHETSHR | |
| SCHEMBL7321044 | 0.92 | SIGMAR1 (0.47) | SLC18A2SLC6A2SLC6A4ACHETSHR | |
| Hydrochloric Acid SCHEMBL7331646 | 0.90 | SIGMAR1 (0.46) | SLC18A2SLC6A2SLC6A4ACHETSHR | |
| SCHEMBL10225170 | 0.78 | CHRNA4 (0.44) | SLC6A2SLC6A4EGFRPOLBCHRM2 | |
| SCHEMBL10225164 | 0.78 | CHRNA4 (0.36) | SLC18A2SLC6A2SLC6A4EGFRPOLB | |
| SCHEMBL10225161 | 0.78 | CHRNA4 (0.36) | SLC18A2SLC6A2SLC6A4ACHEEGFR | |
| SCHEMBL3215425 | 0.76 | CHRNB4 (0.47) | SLC6A2SLC6A4EGFRPOLBCHRM2 | |
| SCHEMBL7330328 | 0.72 | PDK1 (0.46) | — | |
| SCHEMBL9357331 | 0.72 | CHRNB4 (0.43) | SLC6A2SLC6A4EGFRPOLBCHRM2 | |
| Hydrochloric Acid SCHEMBL7321546 | 0.71 | PDK1 (0.46) | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-0625979-A1 | AZABRICYCLIC COMPOUNDS AS CALCIUM CHANNEL ANTAGONISTS | SMITHKLINE BEECHAM PLC (GB) | 1994-11-30 | — | — | EP | claimed |
| WO-1993015073-A1 | AZABRICYCLIC COMPOUNDS AS CALCIUM CHANNEL ANTAGONISTS | SMITHKLINE BEECHAM PLC (GB) | 1993-08-05 | — | — | WO | claimed |