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 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 known ✓ | Q99720 | 4/20 | 0.54 |
| ▸ | SLC6A2 known ✓ | P23975 | 2/20 | 0.54 |
| ▸ | SLC6A4 known ✓ | P31645 | 1/20 | 0.54 |
| ▸ | SLC6A3 known ✓ | Q01959 | 1/20 | 0.54 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.64 |
| ▸ | ANPEP | P15144 | 1/20 | 0.55 |
| ▸ | TAAR1 | Q96RJ0 | 2/20 | 0.54 |
| ▸ | MAOA | P21397 | 1/20 | 0.54 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.54 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.54 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.54 |
| ▸ | CSNK1E | P49674 | 1/20 | 0.53 |
| ▸ | SCN4A | P35499 | 2/20 | 0.50 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL14471186 | 0.98 | EPHX1 (0.67) | EPHX1ANPEPSIGMAR1SLC6A2TAAR1 | |
| SCHEMBL3401432 | 0.98 | EPHX1 (0.67) | EPHX1ANPEPSIGMAR1SLC6A2TAAR1 | |
| SCHEMBL172452 | 0.98 | EPHX1 (0.67) | EPHX1ANPEPSIGMAR1SLC6A2TAAR1 | |
| Hydrochloric Acid SCHEMBL6659825 | 0.96 | EPHX1 (0.64) | EPHX1ANPEPSIGMAR1SLC6A2TAAR1 | |
| SCHEMBL2736211 | 0.94 | EPHX1 (0.61) | EPHX1ANPEPSIGMAR1SLC6A2TAAR1 | |
| Bicarbonate SCHEMBL3217828 | 0.87 | EPHX1 (0.53) | EPHX1ANPEPSIGMAR1SLC6A2TAAR1 | |
| SCHEMBL9468396 | 0.86 | EPHX1 (0.52) | EPHX1ANPEPSIGMAR1SLC6A2TAAR1 | |
| SCHEMBL3847568 | 0.86 | EPHX1 (0.61) | EPHX1ANPEPSIGMAR1SLC6A2TAAR1 | |
| SCHEMBL21469786 | 0.86 | EPHX1 (0.61) | EPHX1ANPEPSIGMAR1SLC6A2TAAR1 | |
| Bromide SCHEMBL14128593 | 0.85 | CSNK1E (0.69) | EPHX1ANPEPSIGMAR1SLC6A2TAAR1 |
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 9 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2760834-A1 | PYRIDINEDIONE CARBOXAMIDE INHIBITORS OF ENDOTHELIAL LIPASE | Bristol-Myers Squibb Company (US) | 2014-08-06 | — | — | EP | disclosed |
| WO-2013048930-A1 | PYRIDINEDIONE CARBOXAMIDE INHIBITORS OF ENDOTHELIAL LIPASE | BRISTOL-MYERS SQUIBB COMPANY (US) | 2013-04-04 | — | — | WO | disclosed |
| EP-1141153-B1 | CROSSLINKING COMPOSITION FOR CARBOXYL-CONTAINING POLYMERS IN HEAT-CURABLE SYSTEMS | VANTICO AG (CH) | 2003-09-10 | — | — | EP | disclosed |
| EP-1141153-A1 | CROSSLINKING AGENT FOR CARBOXYL-CONTAINING POLYMERS IN HEAT-CURABLE SYSTEMS | Vantico AG (CH) | 2001-10-10 | — | — | EP | disclosed |
| US-6100349-A | Thermosetting powder coating composition | AKZO NOBEL N.V. (NL) | 2000-08-08 | — | — | US | disclosed |
| WO-2000029497-A1 | CROSSLINKING AGENT FOR CARBOXYL-CONTAINING POLYMERS IN HEAT-CURABLE SYSTEMS | VANTICO AG (CH) | 2000-05-25 | — | — | WO | disclosed |
| EP-0871682-B1 | THERMOSETTING POWDER COATING COMPOSITION | AKZO NOBEL NV (NL) | 2000-02-02 | — | — | EP | disclosed |
| EP-0871682-A1 | THERMOSETTING POWDER COATING COMPOSITION | Akzo Nobel N.V. (NL) | 1998-10-21 | — | — | EP | disclosed |
| WO-1997024408-A1 | THERMOSETTING POWDER COATING COMPOSITION | AKZO NOBEL N.V. (NL) | 1997-07-10 | — | — | WO | disclosed |