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 | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 6/20 | 0.57 |
| ▸ | NPC1 | O15118 | 11/20 | 0.54 |
| ▸ | RAB9A | P51151 | 11/20 | 0.54 |
| ▸ | TP53 | P04637 | 5/20 | 0.54 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.54 |
| ▸ | GLA | P06280 | 1/20 | 0.54 |
| ▸ | SMN1; SMN2 | Q16637 | 9/20 | 0.54 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.54 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.54 |
| ▸ | MEN1 | O00255 | 3/20 | 0.54 |
| ▸ | HTT | P42858 | 2/20 | 0.54 |
| ▸ | POLB | P06746 | 2/20 | 0.54 |
| ▸ | PKM | P14618 | 1/20 | 0.54 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.54 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.54 |
| ▸ | USP2 | O75604 | 1/20 | 0.54 |
| ▸ | CSNK1D | P48730 | 2/20 | 0.53 |
| ▸ | SCD | O00767 | 3/20 | 0.52 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.52 |
| ▸ | THRB | P10828 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL12199484 | 0.99 | MAPT (0.58) | MAPTNPC1RAB9ATP53KDM4E | |
| Bromide SCHEMBL2484769 | 0.93 | MAPT (0.59) | MAPTNPC1RAB9ATP53KDM4E | |
| Bromide SCHEMBL2483590 | 0.93 | MAPT (0.58) | MAPTNPC1RAB9ATP53KDM4E | |
| SCHEMBL12199478 | 0.92 | MAPT (0.60) | MAPTNPC1RAB9ATP53KDM4E | |
| SCHEMBL12199481 | 0.92 | MAPT (0.59) | MAPTNPC1RAB9ATP53KDM4E | |
| SCHEMBL12199457 | 0.89 | SCD (0.67) | MAPTNPC1RAB9ATP53KDM4E | |
| SCHEMBL12199442 | 0.89 | NPC1 (0.66) | MAPTNPC1RAB9ATP53KDM4E | |
| SCHEMBL12199270 | 0.87 | MAPT (0.52) | MAPTNPC1RAB9ATP53KDM4E | |
| Bromide SCHEMBL2483747 | 0.86 | NPC1 (0.62) | MAPTNPC1RAB9ATP53KDM4E | |
| Bromide SCHEMBL2484246 | 0.86 | SCD (0.64) | MAPTNPC1RAB9ATP53KDM4E |
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 |
|---|---|---|---|---|---|---|---|
| EP-2376463-A1 | BENZOTHIAZOLE AMIDES FOR DETECTION OF AMYLOID BETA | Bayer Pharma Aktiengesellschaft (DE) | 2011-10-19 | — | — | EP | disclosed |
| WO-2010066357-A1 | BENZOTHIAZOLE AMIDES FOR DETECTION OF AMYLOID BETA | BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) | 2010-06-17 | — | — | WO | disclosed |