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 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRA1B known ✓ | P35368 | 1/20 | 0.36 |
| ▸ | HTR1A known ✓ | P08908 | 5/20 | 0.36 |
| ▸ | SLC6A4 known ✓ | P31645 | 5/20 | 0.36 |
| ▸ | ACHE known ✓ | P22303 | 1/20 | 0.34 |
| ▸ | KDM2B | Q8NHM5 | 4/20 | 0.39 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.35 |
| ▸ | BCHE | P06276 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | HCN4 | Q9Y3Q4 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL9209353 | 0.94 | KDM2B (0.44) | KDM2BADRA1BACHE | |
| SCHEMBL9215721 | 0.94 | KDM2B (0.41) | KDM2BADRA1BABCB1 | |
| SCHEMBL9207330 | 0.93 | KDM2B (0.41) | KDM2BADRA1BABCB1ACHE | |
| SCHEMBL9215483 | 0.88 | HTR1A (0.44) | ADRA1BHTR1ASLC6A4ABCB1MAPT | |
| SCHEMBL9204619 | 0.88 | KDM2B (0.42) | KDM2BADRA1BABCB1ACHEMAPT | |
| Hydrochloric Acid SCHEMBL9740149 | 0.88 | KDM2B (0.41) | KDM2BADRA1BABCB1MAPTCYP3A4 | |
| SCHEMBL9215919 | 0.88 | KDM2B (0.41) | KDM2BADRA1BABCB1ACHEMAPT | |
| Hydrochloric Acid SCHEMBL9215495 | 0.84 | KDM2B (0.41) | KDM2BBCHE | |
| SCHEMBL9214818 | 0.84 | SLC6A4 (0.42) | HTR1ASLC6A4ACHE | |
| Hydrochloric Acid SCHEMBL9214727 | 0.84 | KDM2B (0.39) | KDM2BBCHE |
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-0292840-B1 | Cyclic amine derivatives, medicaments containing these compounds and procedure for their preparation | THOMAE GMBH DR K (DE) | 1995-08-09 | — | — | EP | disclosed |
| EP-0292840-A2 | Cyclic amine derivatives, medicaments containing these compounds and procedure for their preparation | Dr. Karl Thomae GmbH (DE) | 1988-11-30 | — | — | EP | disclosed |