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 | |
|---|---|---|---|---|
| ▸ | CLCN2 | P51788 | 1/20 | 0.38 |
| ▸ | TRAP1 | Q12931 | 1/20 | 0.35 |
| ▸ | SNCA | P37840 | 2/20 | 0.34 |
| ▸ | RORC | P51449 | 1/20 | 0.34 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 4/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 4/20 | 0.33 |
| ▸ | MEN1 | O00255 | 3/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.33 |
| ▸ | HPGD | P15428 | 3/20 | 0.33 |
| ▸ | LMNA | P02545 | 2/20 | 0.33 |
| ▸ | NPC1 | O15118 | 2/20 | 0.33 |
| ▸ | RAB9A | P51151 | 2/20 | 0.33 |
| ▸ | HTR2A | P28223 | 2/20 | 0.33 |
| ▸ | HTR2C | P28335 | 2/20 | 0.33 |
| ▸ | HTR2B | P41595 | 2/20 | 0.33 |
| ▸ | LDHA | P00338 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 2/20 | 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 | |
|---|---|---|---|---|
| Bromide SCHEMBL5827732 | 0.83 | DPP4 (0.41) | TRAP1SNCAMAPTL3MBTL1KMT2A | |
| Hydrochloric Acid SCHEMBL11183940 | 0.81 | TRAP1 (0.37) | CLCN2TRAP1HIF1AMAPTL3MBTL1 | |
| Hydrochloric Acid SCHEMBL6366549 | 0.80 | DPP4 (0.41) | TRAP1MAPTL3MBTL1KMT2AHPGD | |
| Hydrochloric Acid SCHEMBL11184208 | 0.78 | TRAP1 (0.39) | CLCN2TRAP1HIF1AMAPTL3MBTL1 | |
| Bromide SCHEMBL4180528 | 0.77 | CA1 (0.43) | TRAP1SNCAHIF1AL3MBTL1ALDH1A1 | |
| Bromide SCHEMBL5828497 | 0.77 | TRAP1 (0.39) | TRAP1SNCAMAPTL3MBTL1MEN1 | |
| Bromide SCHEMBL6585331 | 0.76 | LMNA (0.41) | MAPTMEN1KMT2ALMNAALDH1A1 | |
| Bromide SCHEMBL7084184 | 0.76 | SNCA (0.44) | TRAP1SNCAKMT2AHTR2AHTR2C | |
| Bromide SCHEMBL10721589 | 0.76 | MEN1 (0.47) | SNCAMAPTMEN1KMT2ALMNA | |
| Bromide SCHEMBL5829428 | 0.75 | CHRNA7 (0.39) | TRAP1SNCAHIF1AMAPTL3MBTL1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7094798-B1 | Inhibitors of checkpoint kinases (Wee1 and Chk1) | PFIZER INC (US) | 2006-08-22 | — | — | US | disclosed |
| EP-1501831-A1 | INHIBITORS OF CHECKPOINT KINASES (WEE1 AND CHK1) | WARNER-LAMBERT COMPANY LLC (US) | 2005-02-02 | — | — | EP | disclosed |
| WO-2003091255-A1 | INHIBITORS OF CHECKPOINT KINASES (WEE1 AND CHK1) | WARNER-LAMBERT COMPANY LLC (US) | 2003-11-06 | — | — | WO | disclosed |