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 |
| ▸ | HTR2A | P28223 | 3/20 | 0.46 |
| ▸ | HRH1 | P35367 | 3/20 | 0.46 |
| ▸ | LMNA | P02545 | 1/20 | 0.46 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.46 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.46 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.46 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.45 |
| ▸ | AOC3 | Q16853 | 3/20 | 0.44 |
| ▸ | TRPM8 | Q7Z2W7 | 1/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | NOS3 | P29474 | 1/20 | 0.40 |
| ▸ | NOS2 | P35228 | 1/20 | 0.40 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.40 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.40 |
| ▸ | CCR5 | P51681 | 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 | |
|---|---|---|---|---|
| SCHEMBL8926699 | 0.98 | HTR2A (0.48) | HTR2AHRH1LMNACHRNB2CHRNB4 | |
| SCHEMBL171013 | 0.98 | HTR2A (0.48) | HTR2AHRH1LMNACHRNB2CHRNB4 | |
| SCHEMBL119104 | 0.98 | HTR2A (0.48) | HTR2AHRH1LMNACHRNB2CHRNB4 | |
| Hydrochloric Acid SCHEMBL235622 | 0.95 | TDP1 (0.50) | HTR2AHRH1LMNACHRNB2CHRNB4 | |
| Hydrochloric Acid SCHEMBL18378384 | 0.95 | TDP1 (0.50) | HTR2AHRH1LMNACHRNB2CHRNB4 | |
| Iodide SCHEMBL10962372 | 0.95 | HTR2A (0.46) | HTR2AHRH1LMNACHRNB2CHRNB4 | |
| Hydrochloric Acid SCHEMBL14762879 | 0.95 | TDP1 (0.50) | HTR2AHRH1LMNACHRNB2CHRNB4 | |
| Water SCHEMBL27613449 | 0.95 | HTR2A (0.46) | HTR2AHRH1LMNACHRNB2CHRNB4 | |
| Hydrochloric Acid SCHEMBL8067968 | 0.93 | TDP1 (0.48) | HTR2AHRH1LMNACHRNB2CHRNB4 | |
| Hydrochloric Acid SCHEMBL28230488 | 0.93 | TDP1 (0.48) | HTR2AHRH1LMNACHRNB2CHRNB4 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2009149374-A2 | MULTI-PART CHEMISTRY SYSTEM | REVEAL SCIENCES, LLC (US) | 2009-12-10 | — | — | WO | disclosed |
| WO-2009089496-A2 | COLOR-CHANGING CLEANSING COMPOSITONS AND METHODS | REVEAL SCIENCES, LLC (US) | 2009-07-16 | — | — | WO | disclosed |
| US-20090176673-A1 | COLOR-CHANGING CLEANSING COMPOSITIONS AND METHODS | REVEAL SCIENCES, LLC (US) | 2009-07-09 | — | — | US | disclosed |
| US-4597887-A | Germicidal hard surface cleaning composition | COLGATE-PALMOLIVE COMPANY (US) | 1986-07-01 | — | — | US | disclosed |