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 | |
|---|---|---|---|---|
| ▸ | SIGMAR1 known ✓ | Q99720 | 1/20 | 0.40 |
| ▸ | OPRD1 | P41143 | 2/20 | 0.43 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.43 |
| ▸ | CHRNB2 | P17787 | 5/20 | 0.39 |
| ▸ | CHRNA4 | P43681 | 5/20 | 0.39 |
| ▸ | PRCP | P42785 | 4/20 | 0.37 |
| ▸ | CHRNA7 | P36544 | 2/20 | 0.37 |
| ▸ | KDM1A | O60341 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 2/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.35 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL29705809 | 0.84 | OPRD1 (0.50) | OPRD1KCNH2SIGMAR1PRCP | |
| SCHEMBL4363631 | 0.84 | OPRD1 (0.50) | OPRD1KCNH2SIGMAR1PRCP | |
| SCHEMBL11733261 | 0.81 | OPRD1 (0.50) | OPRD1KCNH2SIGMAR1CHRNB2CHRNA4 | |
| SCHEMBL11870107 | 0.76 | SIGMAR1 (0.43) | OPRD1KCNH2SIGMAR1PRCP | |
| SCHEMBL30508374 | 0.76 | SIGMAR1 (0.46) | OPRD1KCNH2SIGMAR1PRCP | |
| SCHEMBL11782034 | 0.76 | SIGMAR1 (0.46) | OPRD1KCNH2SIGMAR1PRCP | |
| SCHEMBL11686154 | 0.76 | PRCP (0.43) | OPRD1KCNH2SIGMAR1PRCP | |
| SCHEMBL11781458 | 0.76 | OPRD1 (0.46) | OPRD1KCNH2SIGMAR1PRCP | |
| SCHEMBL12175500 | 0.75 | PRCP (0.54) | OPRD1KCNH2SIGMAR1PRCP | |
| SCHEMBL11738009 | 0.73 | SIGMAR1 (0.40) | OPRD1KCNH2SIGMAR1PRCP |
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-4031224-A | 1,3-Dihydro-heteroarylspiro (isobenzofuran)s | AMERICAN HOECHST CORPORATION (US) | 1977-06-21 | — | — | US | disclosed |