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 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 known ✓ | Q99720 | 3/20 | 0.50 |
| ▸ | KCNH2 | Q12809 | 5/20 | 0.49 |
| ▸ | CNR2 | P34972 | 2/20 | 0.46 |
| ▸ | ACKR3 | P25106 | 1/20 | 0.43 |
| ▸ | OPRK1 | P41145 | 2/20 | 0.42 |
| ▸ | DRD2 | P14416 | 1/20 | 0.41 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.41 |
| ▸ | DRD3 | P35462 | 1/20 | 0.41 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | BCHE | P06276 | 1/20 | 0.40 |
| ▸ | DNM1 | Q05193 | 1/20 | 0.40 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.40 |
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 SCHEMBL1330660 | 1.00 | SIGMAR1 (0.50) | SIGMAR1KCNH2CNR2ACKR3OPRK1 | |
| Bromide SCHEMBL1330634 | 1.00 | SIGMAR1 (0.50) | SIGMAR1KCNH2CNR2ACKR3OPRK1 | |
| Bromide SCHEMBL1331166 | 1.00 | SIGMAR1 (0.50) | SIGMAR1KCNH2CNR2ACKR3OPRK1 | |
| Bromide SCHEMBL1329464 | 0.98 | SIGMAR1 (0.49) | SIGMAR1KCNH2CNR2ACKR3OPRK1 | |
| Bromide SCHEMBL1329467 | 0.98 | SIGMAR1 (0.49) | SIGMAR1KCNH2CNR2ACKR3OPRK1 | |
| SCHEMBL23308021 | 0.98 | SIGMAR1 (0.51) | SIGMAR1KCNH2CNR2ACKR3OPRK1 | |
| SCHEMBL666712 | 0.98 | SIGMAR1 (0.51) | SIGMAR1KCNH2CNR2ACKR3OPRK1 | |
| SCHEMBL667263 | 0.98 | SIGMAR1 (0.51) | SIGMAR1KCNH2CNR2ACKR3OPRK1 | |
| SCHEMBL11258123 | 0.98 | SIGMAR1 (0.51) | SIGMAR1KCNH2CNR2ACKR3OPRK1 | |
| SCHEMBL667946 | 0.98 | SIGMAR1 (0.51) | SIGMAR1KCNH2CNR2ACKR3OPRK1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-101316516-B | Antimicrobial solutions and methods relating thereto | BYOCOAT ENTPR INC | 2012-05-30 | — | — | CN | disclosed |
| CN-102083313-A | Compositions and methods for reducing or preventing microorganism growth or survival in aqueous environments | BYOCOAT ENTPR INC | 2011-06-01 | — | — | CN | disclosed |
| CN-101316516-A | Antimicrobial solutions and methods relating thereto | BYOCOAT ENTPR INC (US) | 2008-12-03 | — | — | CN | disclosed |