Known targets — ChEMBL curated mechanism
ACHEADRA1AADRA1BADRA1DADRA2AADRA2BADRA2CADRB1ADRB2ADRB3APH1AAPH1BCHRM2CHRM3EZH2GRIN2AHTR1AHTR1BHTR1DHTR1FHTR3ANCSTNP2RY12PSEN1PSEN2PSENENSIGMAR1SLC6A2SLC6A3SLC6A4
The experimentally established mechanism targets of Bromide. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR1A known ✓ | P08908 | 1/20 | 0.43 |
| ▸ | CHRM2 known ✓ | P08172 | 1/20 | 0.43 |
| ▸ | ADRA2A known ✓ | P08913 | 1/20 | 0.43 |
| ▸ | ADRA2B known ✓ | P18089 | 1/20 | 0.43 |
| ▸ | ADRA2C known ✓ | P18825 | 1/20 | 0.43 |
| ▸ | ADRA1A known ✓ | P35348 | 1/20 | 0.43 |
| ▸ | DRD2 | P14416 | 11/20 | 0.49 |
| ▸ | DRD3 | P35462 | 11/20 | 0.49 |
| ▸ | CACNA2D1 | P54289 | 3/20 | 0.47 |
| ▸ | CACNA1B | Q00975 | 3/20 | 0.47 |
| ▸ | CACNB1 | Q02641 | 3/20 | 0.47 |
| ▸ | CACNA1C | Q13936 | 3/20 | 0.47 |
| ▸ | CACNA1G | O43497 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 1/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.43 |
| ▸ | HTT | P42858 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.43 |
| ▸ | HTR7 | P34969 | 2/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL7098300 | 0.99 | DRD2 (0.49) | DRD2DRD3CACNA2D1CACNA1BCACNB1 | |
| Hydrochloric Acid SCHEMBL7101513 | 0.98 | DRD2 (0.49) | DRD2DRD3CACNA2D1CACNA1BCACNB1 | |
| Hydrochloric Acid SCHEMBL7098258 | 0.98 | DRD2 (0.49) | DRD2DRD3CACNA2D1CACNA1BCACNB1 | |
| SCHEMBL7098340 | 0.96 | DRD2 (0.45) | DRD2DRD3CACNA2D1CACNA1BCACNB1 | |
| Oxalic Acid SCHEMBL7097823 | 0.95 | DRD3 (0.51) | DRD2DRD3CACNA2D1CACNA1BCACNB1 | |
| Fumaric Acid SCHEMBL7957738 | 0.93 | DRD3 (0.49) | DRD2DRD3CACNA2D1CACNA1BCACNB1 | |
| Fumaric Acid SCHEMBL7957768 | 0.93 | DRD3 (0.49) | DRD2DRD3CACNA2D1CACNA1BCACNB1 | |
| SCHEMBL7097625 | 0.90 | DRD3 (0.57) | DRD2DRD3HTR7HTR1AABCB11 | |
| SCHEMBL7099285 | 0.90 | DRD3 (0.57) | DRD2DRD3HTR7HTR1AABCB11 | |
| SCHEMBL7097660 | 0.90 | DRD3 (0.57) | DRD2DRD3HTR7HTR1AABCB11 |
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-1020443-B1 | PROCESS FOR PRODUCING PIPERAZINESULFONAMIDE DERIVATIVES AND SALTS THEREOF | AZWELL INC (JP) | 2003-09-10 | — | — | EP | disclosed |
| US-6172228-B1 | Process for producing piperazinesulfonamide derivatives and salts thereof | AZWELL INC. (JP) | 2001-01-09 | — | — | US | disclosed |
| EP-1020443-A1 | PROCESS FOR PRODUCING PIPERAZINESULFONAMIDE DERIVATIVES AND SALTS THEREOF | Azwell Inc. (JP) | 2000-07-19 | — | — | EP | disclosed |