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 | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.71 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.71 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.69 |
| ▸ | HTR2A | P28223 | 1/20 | 0.65 |
| ▸ | HTR2C | P28335 | 1/20 | 0.65 |
| ▸ | PARP1 | P09874 | 1/20 | 0.59 |
| ▸ | NR2E1 | Q9Y466 | 2/20 | 0.58 |
| ▸ | HTR5A | P47898 | 1/20 | 0.58 |
| ▸ | NISCH | Q9Y2I1 | 1/20 | 0.58 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.56 |
| ▸ | MEN1 | O00255 | 1/20 | 0.53 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.53 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.53 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.53 |
| ▸ | MAPT | P10636 | 1/20 | 0.51 |
| ▸ | DRD2 | P14416 | 1/20 | 0.51 |
| ▸ | DRD1 | P21728 | 1/20 | 0.51 |
| ▸ | DRD4 | P21917 | 1/20 | 0.51 |
| ▸ | DRD5 | P21918 | 1/20 | 0.51 |
| ▸ | DRD3 | P35462 | 1/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL30160092 | 0.98 | KDM4E (0.73) | KDM4EALDH1A1SMN1; SMN2HTR2AHTR2C | |
| SCHEMBL104598 | 0.98 | KDM4E (0.73) | KDM4EALDH1A1SMN1; SMN2HTR2AHTR2C | |
| SCHEMBL30657796 | 0.96 | SMN1; SMN2 (0.74) | KDM4EALDH1A1SMN1; SMN2HTR2AHTR2C | |
| SCHEMBL14156164 | 0.96 | SMN1; SMN2 (0.74) | KDM4EALDH1A1SMN1; SMN2HTR2AHTR2C | |
| Ammonia Solution, Strong SCHEMBL28165982 | 0.96 | KDM4E (0.71) | KDM4EALDH1A1SMN1; SMN2HTR2AHTR2C | |
| SCHEMBL7402531 | 0.96 | KDM4E (0.71) | KDM4EALDH1A1SMN1; SMN2HTR2AHTR2C | |
| Iodide SCHEMBL8569085 | 0.96 | KDM4E (0.71) | KDM4EALDH1A1SMN1; SMN2HTR2AHTR2C | |
| SCHEMBL11641810 | 0.96 | SMN1; SMN2 (0.74) | KDM4EALDH1A1SMN1; SMN2HTR2AHTR2C | |
| SCHEMBL15266076 | 0.96 | KDM4E (0.71) | KDM4EALDH1A1SMN1; SMN2HTR2AHTR2C | |
| Hydrochloric Acid SCHEMBL5776419 | 0.96 | KDM4E (0.71) | KDM4EALDH1A1SMN1; SMN2HTR2AHTR2C |
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 |
|---|---|---|---|---|---|---|---|
| WO-1998011895-A1 | A METHOD FOR THE PREVENTION OF MIGRAINE | ELI LILLY AND COMPANY (US) | 1998-03-26 | — | — | WO | disclosed |
| WO-1998006402-A1 | TREATMENT OF THE COMMON COLD OR ALLERGIC RHINITIS | ELI LILLY AND COMPANY (US) | 1998-02-19 | — | — | WO | disclosed |