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 | 2/20 | 0.35 |
| ▸ | OPRM1 | P35372 | 3/20 | 0.38 |
| ▸ | OPRK1 | P41145 | 3/20 | 0.38 |
| ▸ | OPRD1 | P41143 | 2/20 | 0.38 |
| ▸ | HTR2B | P41595 | 1/20 | 0.35 |
| ▸ | TMEM97 | Q5BJF2 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.35 |
| ▸ | TP53 | P04637 | 2/20 | 0.35 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.35 |
| ▸ | MAPT | P10636 | 2/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.35 |
| ▸ | MTOR | P42345 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | THPO | P40225 | 1/20 | 0.35 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 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 | |
|---|---|---|---|---|
| SCHEMBL9013201 | 0.81 | DRD2 (0.46) | KDM4EMAPTKMT2AHSD17B10MEN1 | |
| SCHEMBL11786022 | 0.79 | DRD2 (0.42) | HTR2BKDM4EMAPTKMT2ADRD2 | |
| SCHEMBL8604280 | 0.79 | OPRM1 (0.36) | OPRM1OPRK1OPRD1SIGMAR1KDM4E | |
| SCHEMBL12198991 | 0.78 | OPRM1 (0.33) | OPRM1OPRK1OPRD1SIGMAR1HTR2B | |
| SCHEMBL11787691 | 0.77 | CNR2 (0.53) | OPRM1HTR2BMAPTKMT2AMEN1 | |
| SCHEMBL9637792 | 0.76 | CRHBP (0.48) | SIGMAR1HTR2BTMEM97MAPTKMT2A | |
| SCHEMBL16980197 | 0.74 | OPRM1 (0.39) | OPRM1OPRK1OPRD1KDM4EMAPT | |
| SCHEMBL12198993 | 0.74 | OPRM1 (0.32) | OPRM1OPRK1OPRD1SIGMAR1HTR2B | |
| SCHEMBL13740895 | 0.73 | MAPT (0.42) | KDM4EMAPTKMT2AMEN1DRD2 | |
| SCHEMBL12352218 | 0.72 | KDM4E (0.52) | SIGMAR1HTR2BTMEM97KDM4EMAPT |
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-0966458-B1 | SULFONATED XANTHENE DERIVATIVES | MOLECULAR PROBES INC (US) | 2003-08-13 | — | — | EP | disclosed |
| US-6130101-A | FLUORESCENT PROBES FOR USE IN BIOLOGICAL SAMPLES | MOLECULAR PROBES, INC. (US) | 2000-10-10 | — | — | US | disclosed |