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 | |
|---|---|---|---|---|
| ▸ | MCL1 | Q07820 | 14/20 | 0.39 |
| ▸ | BCL2 | P10415 | 8/20 | 0.39 |
| ▸ | BCL2L1 | Q07817 | 4/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | PABPC1 | P11940 | 1/20 | 0.38 |
| ▸ | XBP1 | P17861 | 1/20 | 0.38 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | SMARCA2 | P51531 | 1/20 | 0.38 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | RELA | Q04206 | 1/20 | 0.38 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.37 |
| ▸ | PRMT1 | Q99873 | 1/20 | 0.36 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.35 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL29151807 | 0.99 | MCL1 (0.40) | MCL1BCL2BCL2L1KDM4EALDH1A1 | |
| Bromide SCHEMBL28834308 | 0.97 | MCL1 (0.39) | MCL1BCL2BCL2L1KDM4EALDH1A1 | |
| SCHEMBL28834355 | 0.97 | MCL1 (0.41) | MCL1BCL2BCL2L1KDM4EALDH1A1 | |
| SCHEMBL29151803 | 0.96 | MCL1 (0.40) | MCL1BCL2BCL2L1KDM4EALDH1A1 | |
| SCHEMBL28834285 | 0.92 | MCL1 (0.38) | MCL1BCL2BCL2L1KDM4EALDH1A1 | |
| SCHEMBL28834305 | 0.92 | MCL1 (0.39) | MCL1BCL2BCL2L1KDM4EALDH1A1 | |
| Bromide SCHEMBL28952170 | 0.88 | LTA4H (0.41) | MCL1BCL2BCL2L1KDM4EALDH1A1 | |
| SCHEMBL28028179 | 0.88 | LTA4H (0.44) | MCL1BCL2BCL2L1KDM4EALDH1A1 | |
| SCHEMBL29151801 | 0.86 | LTA4H (0.42) | MCL1BCL2BCL2L1KDM4EALDH1A1 | |
| SCHEMBL28952169 | 0.83 | LTA4H (0.40) | MCL1BCL2BCL2L1KDM4EALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-114853964-A | Cycloolefin block copolymer and method for producing the same | 中国石油天然气股份有限公司 | 2022-08-05 | — | — | CN | disclosed |
| CN-114853947-A | Composite catalyst and application thereof | 中国石油天然气股份有限公司 | 2022-08-05 | — | — | CN | disclosed |