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 | |
|---|---|---|---|---|
| ▸ | GRIN2A known ✓ | Q12879 | 1/20 | 0.35 |
| ▸ | XDH | P47989 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.39 |
| ▸ | GABRA1 | P14867 | 4/20 | 0.39 |
| ▸ | GABRB2 | P47870 | 4/20 | 0.39 |
| ▸ | MAPT | P10636 | 3/20 | 0.39 |
| ▸ | MEN1 | O00255 | 3/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.39 |
| ▸ | PPARG | P37231 | 2/20 | 0.39 |
| ▸ | PPARD | Q03181 | 2/20 | 0.39 |
| ▸ | GAA | P10253 | 2/20 | 0.39 |
| ▸ | CNR1 | P21554 | 2/20 | 0.39 |
| ▸ | CNR2 | P34972 | 2/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | ALDH2 | P05091 | 1/20 | 0.39 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.39 |
| ▸ | PPARA | Q07869 | 1/20 | 0.37 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL1325860 | 0.77 | XDH (0.54) | XDHALDH1A1GABRA1GABRB2MAPT | |
| SCHEMBL7879188 | 0.76 | IDO1 (0.32) | ALOX15TSHR | |
| Water SCHEMBL28099990 | 0.75 | XDH (0.52) | XDHALDH1A1GABRA1GABRB2MAPT | |
| Ethylene SCHEMBL28753621 | 0.75 | XDH (0.52) | XDHALDH1A1GABRA1GABRB2MAPT | |
| SCHEMBL4885731 | 0.74 | ALDH1A1 (0.47) | XDHALDH1A1GABRA1GABRB2MAPT | |
| SCHEMBL9637154 | 0.72 | FOLH1 (0.42) | — | |
| SCHEMBL16266794 | 0.72 | — | — | |
| SCHEMBL27090356 | 0.72 | XDH (0.45) | XDHALDH1A1GABRA1GABRB2MAPT | |
| SCHEMBL30581261 | 0.72 | TAAR1 (0.50) | XDHALDH1A1GABRA1GABRB2MAPT | |
| SCHEMBL3185470 | 0.72 | TAAR1 (0.50) | XDHALDH1A1GABRA1GABRB2MAPT |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5976437-A | POLYPHENYL RESINS WITH PENDANT SOLUBILIZING GROUPS; MELT, WET, AND DRY-JET WET SPINNING; ORIENTING BY DRAWING OR STRETCHING; COATING SOLID ARTICLES | MAXDEM INCORPORATED (US) | 1999-11-02 | — | — | US | disclosed |
| US-5789521-A | POLYPHENYL RESINS | MAXDEM INCORPORATED (US) | 1998-08-04 | — | — | US | disclosed |
| US-5654392-A | POLYPHENYL RESINS HAVING SOLUBILIZING SIDE GROUPS | MAXDEM INCORPORATED (US) | 1997-08-05 | — | — | US | disclosed |
| US-5646232-A | MANUFACTURING POLYPHENYL RESINS | MAXDEM INCORPORATED (US) | 1997-07-08 | — | — | US | disclosed |
| US-5646231-A | POLYPHENYL RESINS | MAXDEM, INCORPORATED (US) | 1997-07-08 | — | — | US | disclosed |
| US-5403675-A | Ion exchange structure having solid electrolyte of sulfonated rigid rod polyphenylene, electrodes; high proton conductivity | MAXDEM, INCORPORATED (US) | 1995-04-04 | — | — | US | disclosed |