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 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ATM | Q13315 | 1/20 | 0.43 |
| ▸ | SCN4A | P35499 | 2/20 | 0.41 |
| ▸ | MAPT | P10636 | 3/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 2/20 | 0.39 |
| ▸ | BCHE | P06276 | 3/20 | 0.39 |
| ▸ | MAOB | P27338 | 2/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
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 SCHEMBL22412426 | 0.83 | HTT (0.50) | ATMMAPTCYP3A4CYP2D6ALDH1A1 | |
| Bromide SCHEMBL22412638 | 0.80 | HTT (0.43) | ATMSCN4AMAPTCYP3A4CYP2D6 | |
| Bromide SCHEMBL22412696 | 0.80 | ATM (0.59) | ATMSCN4AMAPTPOLBLMNA | |
| SCHEMBL22407695 | 0.74 | ALDH1A1 (0.52) | POLBLMNABCHEMAOBCYP1A2 | |
| SCHEMBL22435855 | 0.73 | ATM (0.49) | ATMSCN4AMAPTLMNACYP3A4 | |
| SCHEMBL18485512 | 0.68 | ATM (0.68) | ATMSCN4AMAPTPOLBLMNA | |
| SCHEMBL22203980 | 0.68 | ATM (0.63) | ATMPOLBLMNACYP3A4CYP2D6 | |
| SCHEMBL18485516 | 0.67 | ATM (0.66) | ATMPOLBLMNACYP3A4CYP2D6 | |
| SCHEMBL22407724 | 0.67 | ATM (0.66) | ATMPOLBLMNACYP3A4CYP2D6 | |
| SCHEMBL25626066 | 0.67 | LMNA (0.38) | SCN4AMAPTLMNABCHECYP1A2 |
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-3938345-A1 | CHARGED ION CHANNEL BLOCKERS AND METHODS FOR USE | Nocion Therapeutics, Inc. (US) | 2022-01-19 | — | — | EP | disclosed |
| WO-2020185830-A1 | CHARGED ION CHANNEL BLOCKERS AND METHODS FOR USE | Nocion Therapeutics, Inc. (US) | 2020-09-17 | — | — | WO | disclosed |