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 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRA2A known ✓ | P08913 | 1/20 | 0.44 |
| ▸ | ADRA2B known ✓ | P18089 | 1/20 | 0.44 |
| ▸ | ADRA2C known ✓ | P18825 | 1/20 | 0.44 |
| ▸ | HCAR3 | P49019 | 3/20 | 0.58 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.54 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.54 |
| ▸ | MAPT | P10636 | 2/20 | 0.54 |
| ▸ | HPGD | P15428 | 2/20 | 0.54 |
| ▸ | GAA | P10253 | 1/20 | 0.54 |
| ▸ | CNR2 | P34972 | 1/20 | 0.50 |
| ▸ | TLR8 | Q9NR97 | 2/20 | 0.46 |
| ▸ | ACKR3 | P25106 | 2/20 | 0.44 |
| ▸ | RAB9A | P51151 | 2/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | UTS2R | Q9UKP6 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL10604098 | 0.98 | HCAR3 (0.59) | HCAR3ALDH1A1KDM4EMAPTHPGD | |
| SCHEMBL22265370 | 0.91 | HCAR3 (0.59) | HCAR3ALDH1A1KDM4EMAPTHPGD | |
| SCHEMBL10293613 | 0.87 | HCAR3 (0.57) | HCAR3ALDH1A1KDM4EMAPTHPGD | |
| SCHEMBL6645913 | 0.85 | MAPT (0.53) | HCAR3ALDH1A1KDM4EMAPTHPGD | |
| SCHEMBL10737266 | 0.82 | HRH3 (0.47) | HCAR3ALDH1A1KDM4EMAPTHPGD | |
| SCHEMBL15743909 | 0.80 | RAB9A (0.51) | HCAR3ALDH1A1KDM4EMAPTHPGD | |
| SCHEMBL15743947 | 0.79 | CYP2C19 (0.46) | HCAR3ALDH1A1KDM4EMAPTHPGD | |
| SCHEMBL81827 | 0.79 | HCAR3 (0.55) | HCAR3ALDH1A1KDM4EMAPTHPGD | |
| SCHEMBL22795638 | 0.79 | RAB9A (0.61) | HCAR3ALDH1A1KDM4EMAPTHPGD | |
| SCHEMBL13103613 | 0.78 | RAB9A (0.47) | HCAR3ALDH1A1KDM4EMAPTHPGD |
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-0091790-B1 | PROCESS FOR PREPARING 2-ALKYLAMINO- AND 2-AMINO-5-ALKYLPYRIDINES | REILLY INDUSTRIES, INC. (US) | 1989-11-15 | — | — | EP | disclosed |
| EP-0091790-A2 | Process for preparing 2-alkylamino- and 2-amino-5-alkylpyridines | REILLY INDUSTRIES, INC. (US) | 1983-10-19 | — | — | EP | disclosed |
| US-4405790-A | FROM 3-ALKYLPYRIDINE; SODIUM ALKYLAMIDE | REILLY TAR & CHEMICAL CORP. (US) | 1983-09-20 | — | — | US | disclosed |