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 | |
|---|---|---|---|---|
| ▸ | HTR1A known ✓ | P08908 | 7/20 | 0.48 |
| ▸ | SLC6A4 known ✓ | P31645 | 2/20 | 0.48 |
| ▸ | HTR1D known ✓ | P28221 | 3/20 | 0.48 |
| ▸ | HTR1B known ✓ | P28222 | 2/20 | 0.48 |
| ▸ | HTR1F known ✓ | P30939 | 1/20 | 0.44 |
| ▸ | HTR3A known ✓ | P46098 | 1/20 | 0.44 |
| ▸ | HTR2C | P28335 | 8/20 | 0.48 |
| ▸ | HTR2A | P28223 | 5/20 | 0.48 |
| ▸ | HTR2B | P41595 | 4/20 | 0.48 |
| ▸ | NPSR1 | Q6W5P4 | 4/20 | 0.48 |
| ▸ | NFKB1 | P19838 | 3/20 | 0.48 |
| ▸ | TSHR | P16473 | 3/20 | 0.48 |
| ▸ | BLM | P54132 | 2/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.48 |
| ▸ | HTR7 | P34969 | 2/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.48 |
| ▸ | LMNA | P02545 | 2/20 | 0.48 |
| ▸ | MAPT | P10636 | 2/20 | 0.48 |
| ▸ | PMP22 | Q01453 | 2/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL6469548 | 0.78 | HTR2C (0.60) | HTR2CHTR1AHTR2AHTR2BNPSR1 | |
| SCHEMBL1667862 | 0.77 | NPSR1 (0.59) | HTR2CHTR1AHTR2AHTR2BNPSR1 | |
| SCHEMBL10821180 | 0.76 | NPSR1 (0.51) | HTR2CHTR1AHTR2AHTR2BNPSR1 | |
| SCHEMBL10821260 | 0.76 | GPR84 (0.54) | HTR2CHTR1AHTR2AHTR2BTSHR | |
| SCHEMBL28414477 | 0.76 | GPR84 (0.54) | HTR2CHTR1AHTR2AHTR2BTSHR | |
| SCHEMBL8205708 | 0.75 | HTR2C (0.57) | HTR2CHTR1AHTR2AHTR2BNPSR1 | |
| Hydrochloric Acid SCHEMBL10821237 | 0.74 | GPR84 (0.53) | HTR2CHTR1AHTR2AHTR2BTSHR | |
| SCHEMBL7289880 | 0.74 | NPSR1 (0.59) | HTR2CHTR1AHTR2AHTR2BNPSR1 | |
| SCHEMBL7292022 | 0.74 | HTR2C (0.56) | HTR2CHTR1AHTR2AHTR2BNPSR1 | |
| SCHEMBL6516528 | 0.74 | HTR2C (0.55) | HTR2CHTR1AHTR2AHTR2BNPSR1 |
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-4604386-A | CONTROL OF GRAMPOSITIVE BACTERIA | ELI LILLY AND COMPANY (US) | 1986-08-05 | — | — | US | disclosed |
| EP-0168222-A2 | 3-(Alkynylalkyloxy) Cephalosporins | ELI LILLY AND COMPANY (US) | 1986-01-15 | — | — | EP | disclosed |