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 | |
|---|---|---|---|---|
| ▸ | ADRA2B known ✓ | P18089 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 8/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 5/20 | 0.45 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.45 |
| ▸ | CASP1 | P29466 | 1/20 | 0.45 |
| ▸ | CASP7 | P55210 | 1/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.45 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.39 |
| ▸ | TSHR | P16473 | 7/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 4/20 | 0.35 |
| ▸ | MEN1 | O00255 | 3/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.35 |
| ▸ | GAA | P10253 | 2/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.35 |
| ▸ | APOBEC3G | Q9HC16 | 1/20 | 0.35 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.33 |
| ▸ | HPGD | P15428 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL30273 | 0.97 | — | — | |
| SCHEMBL29440543 | 0.97 | — | — | |
| Hydrochloric Acid SCHEMBL9057722 | 0.95 | ALDH1A1 (0.48) | ALDH1A1CYP3A4ALOX15CASP1CASP7 | |
| SCHEMBL27494273 | 0.95 | ALDH1A1 (0.48) | ALDH1A1CYP3A4ALOX15CASP1CASP7 | |
| Hydrochloric Acid SCHEMBL9494075 | 0.95 | ALDH1A1 (0.48) | ALDH1A1CYP3A4ALOX15CASP1CASP7 | |
| Butadiene SCHEMBL27953309 | 0.92 | ALDH1A1 (0.46) | ALDH1A1CYP3A4ALOX15CASP1CASP7 | |
| Phenol SCHEMBL27342561 | 0.84 | CA14 (0.46) | ALDH1A1CYP3A4ALOX15CASP1CASP7 | |
| Ethylbenzene SCHEMBL7596186 | 0.80 | TP53 (0.52) | ALDH1A1CYP3A4SMN1; SMN2L3MBTL1TSHR | |
| SCHEMBL9191542 | 0.78 | ALDH1A1 (0.59) | ALDH1A1CYP3A4ALOX15CASP1CASP7 | |
| SCHEMBL1083041 | 0.77 | CYP3A4 (0.43) | ALDH1A1CYP3A4ALOX15CASP1CASP7 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-1326330-A | Therapeutic use of polymers | BIOCOMPATIBLES LTD (GB) | 2001-12-12 | — | — | CN | disclosed |
| EP-1141124-A1 | ANIONIC-CATIONIC POLYION COMPLEXES COMPRISING ZWITTERIONIC MONOMER COMPONENT | BIOCOMPATIBLES LTD. (GB) | 2001-10-10 | — | — | EP | disclosed |
| EP-1128784-A1 | THERAPEUTIC USE OF POLYMERS | BIOCOMPATIBLES LTD. (GB) | 2001-09-05 | — | — | EP | disclosed |
| WO-2000029481-A1 | ANIONIC-CATIONIC POLYION COMPLEXES COMPRISING ZWITTERIONIC MONOMER COMPONENT | BIOCOMPATIBLES LIMITED (GB) | 2000-05-25 | — | — | WO | disclosed |
| WO-2000028920-A1 | THERAPEUTIC USE OF POLYMERS | BIOCOMPATIBLES LIMITED (GB) | 2000-05-25 | — | — | WO | disclosed |