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 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CXCR4 | P61073 | 2/20 | 0.96 |
| ▸ | CYP2A13 | Q16696 | 6/20 | 0.53 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.52 |
| ▸ | MEN1 | O00255 | 1/20 | 0.52 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.52 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.51 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.51 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.49 |
| ▸ | NCF1 | P14598 | 1/20 | 0.49 |
| ▸ | HTT | P42858 | 1/20 | 0.49 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.48 |
| ▸ | HPGD | P15428 | 1/20 | 0.47 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.47 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL29604383 | 0.98 | CXCR4 (1.00) | CXCR4CYP2A13ALDH1A1MEN1KMT2A | |
| Hydrochloric Acid SCHEMBL29604752 | 0.96 | CXCR4 (0.96) | CXCR4CYP2A13ALDH1A1MEN1KMT2A | |
| SCHEMBL946921 | 0.90 | CXCR4 (0.83) | CXCR4CYP2A13ALDH1A1MEN1KMT2A | |
| SCHEMBL22304486 | 0.90 | CXCR4 (0.83) | CXCR4CYP2A13ALDH1A1MEN1KMT2A | |
| SCHEMBL13273494 | 0.90 | CXCR4 (0.83) | CXCR4CYP2A13ALDH1A1MEN1KMT2A | |
| SCHEMBL465823 | 0.86 | CXCR4 (0.77) | CXCR4CYP2A13ALDH1A1MEN1KMT2A | |
| SCHEMBL31372331 | 0.86 | CXCR4 (0.77) | CXCR4CYP2A13ALDH1A1MEN1KMT2A | |
| SCHEMBL13273129 | 0.86 | CXCR4 (0.77) | CXCR4CYP2A13ALDH1A1MEN1KMT2A | |
| SCHEMBL938862 | 0.86 | CXCR4 (0.77) | CXCR4CYP2A13ALDH1A1MEN1KMT2A | |
| SCHEMBL4547964 | 0.86 | CXCR4 (0.77) | CXCR4CYP2A13ALDH1A1MEN1KMT2A |
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 |
|---|---|---|---|---|---|---|---|
| EP-3634950-B1 | COBALT COMPLEXES, PROCESS FOR PREPARATION AND USE THEREOF | COUNCIL SCIENT IND RES (IN) | 2022-03-09 | — | — | EP | claimed |