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 | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.54 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.47 |
| ▸ | HTT | P42858 | 2/20 | 0.47 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.46 |
| ▸ | BCAT2 | O15382 | 1/20 | 0.46 |
| ▸ | CHRNB2 | P17787 | 4/20 | 0.46 |
| ▸ | CHRNB4 | P30926 | 4/20 | 0.46 |
| ▸ | CHRNA3 | P32297 | 4/20 | 0.46 |
| ▸ | CHRNA4 | P43681 | 4/20 | 0.46 |
| ▸ | GAA | P10253 | 1/20 | 0.45 |
| ▸ | MAPT | P10636 | 1/20 | 0.45 |
| ▸ | CYP46A1 | Q9Y6A2 | 1/20 | 0.44 |
| ▸ | MEN1 | O00255 | 2/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | MMP13 | P45452 | 1/20 | 0.42 |
| ▸ | GPR52 | Q9Y2T5 | 1/20 | 0.41 |
| ▸ | LTB4R2 | Q9NPC1 | 1/20 | 0.41 |
| ▸ | PLOD2 | O00469 | 1/20 | 0.41 |
| ▸ | PLOD3 | O60568 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| Bromide SCHEMBL8967719 | 0.78 | MAPK1 (0.59) | ALDH1A1CYP19A1GAAMAPTSMN1; SMN2 | |
| Bromide SCHEMBL2691175 | 0.78 | ALDH1A1 (0.56) | ALDH1A1KMT2ACYP19A1GAAMAPT | |
| SCHEMBL1156806 | 0.76 | JAK2 (0.53) | ALDH1A1KMT2AHTTCYP19A1GAA | |
| SCHEMBL5258963 | 0.76 | MAPK1 (0.60) | ALDH1A1CYP19A1GAAMAPTSMN1; SMN2 | |
| SCHEMBL6794827 | 0.74 | ALDH1A1 (0.60) | ALDH1A1KMT2ABCAT2CHRNB2CHRNB4 | |
| SCHEMBL1157353 | 0.74 | ALDH1A1 (0.66) | ALDH1A1KMT2AHTTCYP19A1GAA | |
| Bromide SCHEMBL28360787 | 0.74 | ALDH1A1 (0.60) | ALDH1A1KMT2AHTTBCAT2CHRNB2 | |
| Iodide SCHEMBL1485887 | 0.74 | ALDH1A1 (0.56) | ALDH1A1KMT2ACYP19A1GAAMAPT | |
| Hydrochloric Acid SCHEMBL3250074 | 0.74 | CYP19A1 (0.45) | ALDH1A1KMT2ACYP19A1GAAMAPT | |
| Hydrochloric Acid SCHEMBL3251439 | 0.74 | CYP19A1 (0.45) | ALDH1A1KMT2ACYP19A1GAAMAPT |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5541032-A | CHARGE STABILIZERS WHICH ARE INSENSITIVE TO MOISTURE, HEAT RESISTANT AND PRODUCE CRISP, UNIFORM VISIBLE IMAGES OF HIGH COLOR INTENSITY | BASF AKTIENGESELLSCHAFT (DE) | 1996-07-30 | — | — | US | disclosed |