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 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A2 known ✓ | P23975 | 1/20 | 0.49 |
| ▸ | SLC6A4 known ✓ | P31645 | 1/20 | 0.49 |
| ▸ | SLC6A3 known ✓ | Q01959 | 1/20 | 0.49 |
| ▸ | SIGMAR1 known ✓ | Q99720 | 3/20 | 0.47 |
| ▸ | OPRM1 | P35372 | 10/20 | 0.49 |
| ▸ | OPRD1 | P41143 | 10/20 | 0.49 |
| ▸ | OPRK1 | P41145 | 10/20 | 0.49 |
| ▸ | HTR2A | P28223 | 1/20 | 0.46 |
| ▸ | HTR2C | P28335 | 1/20 | 0.46 |
| ▸ | HTR2B | P41595 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL11260608 | 0.99 | OPRM1 (0.50) | OPRM1OPRD1OPRK1SLC6A2SLC6A4 | |
| SCHEMBL11533931 | 0.95 | SLC6A2 (0.56) | OPRM1OPRD1OPRK1SLC6A2SLC6A4 | |
| SCHEMBL11533934 | 0.95 | SLC6A2 (0.56) | OPRM1OPRD1OPRK1SLC6A2SLC6A4 | |
| Bromide SCHEMBL11267877 | 0.89 | OPRM1 (0.66) | OPRM1OPRD1OPRK1 | |
| SCHEMBL11254924 | 0.87 | OPRM1 (0.67) | OPRM1OPRD1OPRK1 | |
| Bromide SCHEMBL11251114 | 0.86 | SLC6A4 (0.53) | OPRM1OPRD1OPRK1SLC6A2SLC6A4 | |
| SCHEMBL11243848 | 0.85 | OPRM1 (0.49) | OPRM1OPRD1OPRK1SLC6A2SLC6A4 | |
| SCHEMBL11537943 | 0.84 | OPRM1 (0.53) | OPRM1OPRD1OPRK1SLC6A2SLC6A4 | |
| SCHEMBL11537945 | 0.84 | OPRM1 (0.53) | OPRM1OPRD1OPRK1SLC6A2SLC6A4 | |
| SCHEMBL11533477 | 0.84 | OPRM1 (0.70) | OPRM1OPRD1OPRK1 |
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-4337341-A | 4a-Aryl-octahydro-1H-2-pyrindines | ELI LILLY AND COMPANY (US) | 1982-06-29 | — | — | US | disclosed |