Known targets — ChEMBL curated mechanism
ACHECHKACHRM1CHRM2CHRM3CHRM4CHRM5CHRNA1CHRNB1CHRNDCHRNECHRNGHRH2OPRM1
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 | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.59 |
| ▸ | MEN1 | O00255 | 2/20 | 0.59 |
| ▸ | HSP90AA1 | P07900 | 2/20 | 0.59 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.59 |
| ▸ | APAF1 | O14727 | 1/20 | 0.59 |
| ▸ | NPC1 | O15118 | 1/20 | 0.59 |
| ▸ | PLA2G1B | P04054 | 1/20 | 0.59 |
| ▸ | MAPT | P10636 | 1/20 | 0.59 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.59 |
| ▸ | HTT | P42858 | 1/20 | 0.59 |
| ▸ | RAB9A | P51151 | 1/20 | 0.59 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.59 |
| ▸ | ATG4B | Q9Y4P1 | 1/20 | 0.59 |
| ▸ | CA12 | O43570 | 1/20 | 0.37 |
| ▸ | CA1 | P00915 | 1/20 | 0.37 |
| ▸ | CA2 | P00918 | 1/20 | 0.37 |
| ▸ | CA9 | Q16790 | 1/20 | 0.37 |
| ▸ | FDPS | P14324 | 2/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL372789 | 0.98 | SMN1; SMN2 (0.56) | SMN1; SMN2MEN1HSP90AA1KMT2AAPAF1 | |
| Hydrochloric Acid SCHEMBL2229190 | 0.96 | SMN1; SMN2 (0.54) | SMN1; SMN2MEN1HSP90AA1KMT2AAPAF1 | |
| Cyanamide SCHEMBL1340736 | 0.93 | SMN1; SMN2 (0.51) | SMN1; SMN2MEN1HSP90AA1KMT2AAPAF1 | |
| Bromide SCHEMBL9547363 | 0.93 | SMN1; SMN2 (0.65) | SMN1; SMN2MEN1HSP90AA1KMT2AAPAF1 | |
| SCHEMBL18507044 | 0.93 | SMN1; SMN2 (0.59) | SMN1; SMN2MEN1HSP90AA1KMT2AAPAF1 | |
| SCHEMBL4252320 | 0.92 | SMN1; SMN2 (0.50) | SMN1; SMN2MEN1HSP90AA1KMT2AAPAF1 | |
| SCHEMBL1340737 | 0.90 | MEN1 (0.49) | SMN1; SMN2MEN1HSP90AA1KMT2AAPAF1 | |
| SCHEMBL29624315 | 0.90 | MEN1 (0.49) | SMN1; SMN2MEN1HSP90AA1KMT2AAPAF1 | |
| SCHEMBL372622 | 0.87 | SMN1; SMN2 (0.50) | SMN1; SMN2MEN1HSP90AA1KMT2AAPAF1 | |
| Water SCHEMBL28178852 | 0.85 | SMN1; SMN2 (0.49) | SMN1; SMN2MEN1HSP90AA1KMT2AAPAF1 |
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 |
|---|---|---|---|---|---|---|---|
| US-11795583-B2 | Plasticized melt spinning process using ionic liquids for production of polyacrylonitrile fibers | UT-BATTELLE, LLC (US) | 2023-10-24 | — | — | US | disclosed |
| US-20220235493-A1 | PLASTICIZED MELT SPINNING PROCESS USING IONIC LIQUIDS FOR PRODUCTION OF POLYACRYLONITRILE FIBERS | UNIVERSITY OF TENNESSEE RESEARCH FOUNDATION | 2022-07-28 | — | — | US | disclosed |