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 | 1/20 | 0.35 |
| ▸ | KDM1A | O60341 | 4/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.40 |
| ▸ | DRD3 | P35462 | 3/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 3/20 | 0.38 |
| ▸ | TP53 | P04637 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | Q9HBH1 | 1/20 | 0.37 | |
| ▸ | DRD2 | P14416 | 2/20 | 0.37 |
| ▸ | GFER | P55789 | 1/20 | 0.37 |
| ▸ | BCHE | P06276 | 2/20 | 0.36 |
| ▸ | MAOA | P21397 | 1/20 | 0.36 |
| ▸ | DRD4 | P21917 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL29878442 | 0.98 | KDM1A (0.48) | KDM1ACYP1A2CYP2D6ALDH1A1DRD3 | |
| SCHEMBL9715453 | 0.98 | KDM1A (0.48) | KDM1ACYP1A2CYP2D6ALDH1A1DRD3 | |
| Bromide SCHEMBL9625797 | 0.94 | ALDH1A1 (0.45) | KDM1ACYP1A2CYP2D6ALDH1A1CYP2C19 | |
| Bromide SCHEMBL9694372 | 0.94 | ALDH1A1 (0.45) | KDM1ACYP1A2CYP2D6ALDH1A1CYP2C19 | |
| SCHEMBL4304928 | 0.93 | KDM1A (0.43) | KDM1ACYP1A2CYP2D6ALDH1A1DRD3 | |
| SCHEMBL9722988 | 0.92 | LMNA (0.43) | KDM1ACYP1A2CYP2D6ALDH1A1CYP2C19 | |
| SCHEMBL9064444 | 0.92 | LMNA (0.43) | KDM1ACYP1A2CYP2D6ALDH1A1CYP2C19 | |
| SCHEMBL9037704 | 0.92 | LMNA (0.43) | KDM1ACYP1A2CYP2D6ALDH1A1CYP2C19 | |
| SCHEMBL29306541 | 0.92 | LMNA (0.43) | KDM1ACYP1A2CYP2D6ALDH1A1CYP2C19 | |
| Iodide SCHEMBL9038446 | 0.90 | LMNA (0.42) | KDM1ACYP1A2CYP2D6ALDH1A1CYP2C19 |
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 9 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5097089-A | By self-condensation to dihydroxyacetone which is separated and catalytically hydrogenated | BP CHEMICALS LIMITED (GB) | 1992-03-17 | — | — | US | claimed |
| EP-0306215-A2 | Synthesis of glycerol from formaldehyde | BP Chemicals Limited (GB) | 1989-03-08 | — | — | EP | claimed |
| US-5097089-A | By self-condensation to dihydroxyacetone which is separated and catalytically hydrogenated | BP CHEMICALS LIMITED (GB) | 1992-03-17 | — | — | US | disclosed |
| EP-0474387-A1 | Synthesis of alpha-hydroxy ketones | BP Chemicals Limited (GB) | 1992-03-11 | — | — | EP | disclosed |
| US-5087761-A | Condensing aldehydes in liquid phase with active catalyst formed by removing anion from thiazolium salt | BP CHEMICALS LIMITED (GB) | 1992-02-11 | — | — | US | disclosed |
| EP-0410613-A1 | Synthesis of alpha-hydroxy ketones | BP Chemicals Limited (GB) | 1991-01-30 | — | — | EP | disclosed |
| EP-0306215-A2 | Synthesis of glycerol from formaldehyde | BP Chemicals Limited (GB) | 1989-03-08 | — | — | EP | disclosed |
| US-4775448-A | THIN FILM EVAPORATORS TO DISTIL DIHYDROXYACETONE FROM SOLVENT | IMPERIAL CHEMICAL INDUSTRIES PLC (GB) | 1988-10-04 | — | — | US | disclosed |
| EP-0245976-A1 | Process for the isolation of dihydroxyacetone | IMPERIAL CHEMICAL INDUSTRIES PLC (GB) | 1987-11-19 | — | — | EP | disclosed |