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 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A2 known ✓ | P23975 | 3/20 | 0.44 |
| ▸ | SLC6A4 known ✓ | P31645 | 3/20 | 0.44 |
| ▸ | HTR1B known ✓ | P28222 | 1/20 | 0.44 |
| ▸ | SIGMAR1 known ✓ | Q99720 | 1/20 | 0.42 |
| ▸ | SOS1 | Q07889 | 1/20 | 0.54 |
| ▸ | GAA | P10253 | 1/20 | 0.44 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.44 |
| ▸ | CHRM1 | P11229 | 2/20 | 0.44 |
| ▸ | KDM1A | O60341 | 4/20 | 0.44 |
| ▸ | CISD1 | Q9NZ45 | 1/20 | 0.44 |
| ▸ | MAOB | P27338 | 1/20 | 0.44 |
| ▸ | HTR2A | P28223 | 1/20 | 0.44 |
| ▸ | SLC18A3 | Q16572 | 1/20 | 0.42 |
| ▸ | MAOA | P21397 | 1/20 | 0.41 |
| ▸ | MGLL | Q99685 | 1/20 | 0.40 |
| ▸ | HRH1 | P35367 | 1/20 | 0.39 |
| ▸ | GBA1 | P04062 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL6030479 | 0.98 | SOS1 (0.56) | SOS1GAAL3MBTL1SLC6A2SLC6A4 | |
| Bromide SCHEMBL7978275 | 0.96 | SOS1 (0.54) | SOS1GAAL3MBTL1SLC6A2SLC6A4 | |
| Hydrochloric Acid SCHEMBL6984774 | 0.96 | SOS1 (0.54) | SOS1GAAL3MBTL1SLC6A2SLC6A4 | |
| Propane SCHEMBL27576811 | 0.90 | SOS1 (0.53) | SOS1GAAL3MBTL1SLC6A2SLC6A4 | |
| SCHEMBL11522552 | 0.80 | GAA (0.66) | GAAL3MBTL1SLC6A2SLC6A4CHRM1 | |
| SCHEMBL4153139 | 0.80 | GAA (0.71) | SOS1GAAL3MBTL1SLC6A2SLC6A4 | |
| SCHEMBL6983805 | 0.80 | CHRM1 (0.61) | SLC6A2SLC6A4CHRM1 | |
| SCHEMBL6023381 | 0.79 | SLC6A4 (0.44) | SOS1GAAL3MBTL1SLC6A2SLC6A4 | |
| SCHEMBL16180045 | 0.79 | GAA (0.63) | GAAL3MBTL1SLC6A2SLC6A4CHRM1 | |
| SCHEMBL14848196 | 0.79 | GAA (0.63) | GAAL3MBTL1SLC6A2SLC6A4CHRM1 |
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-6255323-B1 | Cyanoguanidine compounds | SHIONOGI BIORESEARCH CORP. | 2001-07-03 | — | — | US | disclosed |
| WO-2000061561-A1 | CYANOGUANIDINE COMPOUNDS | SHIONOGI BIORESEARCH CORP. (US) | 2000-10-19 | — | — | WO | disclosed |