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 | |
|---|---|---|---|---|
| ▸ | SIGMAR1 known ✓ | Q99720 | 1/20 | 0.38 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.40 |
| ▸ | BRD4 | O60885 | 2/20 | 0.39 |
| ▸ | P2RX4 | Q99571 | 2/20 | 0.36 |
| ▸ | SIRT1 | Q96EB6 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 3/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | DDB1 | Q16531 | 1/20 | 0.36 |
| ▸ | CRBN | Q96SW2 | 1/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.35 |
| ▸ | CACNA1G | O43497 | 1/20 | 0.35 |
| ▸ | CACNA1H | O95180 | 1/20 | 0.35 |
| ▸ | CACNA1I | Q9P0X4 | 1/20 | 0.35 |
| ▸ | GSK3A | P49840 | 1/20 | 0.35 |
| ▸ | GSK3B | P49841 | 1/20 | 0.35 |
| ▸ | MGLL | Q99685 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 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 | |
|---|---|---|---|---|
| SCHEMBL27540773 | 0.98 | EPHX2 (0.41) | EPHX2BRD4SIGMAR1P2RX4SIRT1 | |
| Hydrochloric Acid SCHEMBL28844174 | 0.97 | EPHX2 (0.40) | EPHX2BRD4SIGMAR1P2RX4SIRT1 | |
| SCHEMBL28641047 | 0.92 | EPHX2 (0.37) | EPHX2BRD4SIGMAR1P2RX4SIRT1 | |
| SCHEMBL27520031 | 0.91 | EPHX2 (0.36) | EPHX2BRD4SIGMAR1P2RX4SIRT1 | |
| SCHEMBL27542961 | 0.91 | EPHX2 (0.36) | EPHX2BRD4SIGMAR1P2RX4SIRT1 | |
| SCHEMBL28075663 | 0.91 | EPHX2 (0.36) | EPHX2BRD4SIGMAR1P2RX4SIRT1 | |
| SCHEMBL28203325 | 0.85 | CACNA1I (0.34) | CACNA1ICYP2D6CYP2C9 | |
| SCHEMBL28148792 | 0.82 | HTR6 (0.41) | L3MBTL1KMT2ACYP2D6CYP2C9CYP2C19 | |
| SCHEMBL30783424 | 0.82 | SIGMAR1 (0.48) | SIGMAR1P2RX4SIRT1LMNAL3MBTL1 | |
| SCHEMBL29496901 | 0.80 | KMT2A (0.45) | KMT2A |
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 |
|---|---|---|---|---|---|---|---|
| CN-110049989-A | Light produces lewis acid agent | 株式会社日本触媒 | 2019-07-23 | — | — | CN | disclosed |