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 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.58 |
| ▸ | TSHR | P16473 | 3/20 | 0.47 |
| ▸ | THRB | P10828 | 2/20 | 0.36 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.33 |
| ▸ | CA1 | P00915 | 1/20 | 0.32 |
| ▸ | CA2 | P00918 | 1/20 | 0.32 |
| ▸ | ZDHHC7 | Q9NXF8 | 1/20 | 0.31 |
| ▸ | CES1 | P23141 | 1/20 | 0.30 |
| ▸ | THRA | P10827 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL8733801 | 0.96 | ALDH1A1 (0.58) | ALDH1A1TSHRTHRBEPHX1CA1 | |
| Bromide SCHEMBL8730937 | 0.93 | ALDH1A1 (0.54) | ALDH1A1TSHRTHRBEPHX1ZDHHC7 | |
| Hydrochloric Acid SCHEMBL8735034 | 0.89 | ALDH1A1 (0.54) | ALDH1A1TSHRTHRBEPHX1ZDHHC7 | |
| Hexane SCHEMBL27951935 | 0.86 | ALDH1A1 (0.71) | ALDH1A1TSHRTHRBEPHX1CA1 | |
| Heptane SCHEMBL8159285 | 0.84 | ALDH1A1 (0.68) | ALDH1A1TSHRTHRBEPHX1ZDHHC7 | |
| SCHEMBL28627394 | 0.81 | TSHR (0.62) | ALDH1A1TSHRTHRBEPHX1 | |
| Bromide SCHEMBL28739442 | 0.81 | TSHR (0.77) | ALDH1A1TSHRTHRBEPHX1 | |
| Butane SCHEMBL7941631 | 0.81 | ALDH1A1 (0.79) | ALDH1A1TSHRTHRBEPHX1 | |
| Butyl Alcohol SCHEMBL20566101 | 0.80 | ALDH1A1 (0.62) | ALDH1A1TSHRTHRBEPHX1 | |
| Methacrylic Acid SCHEMBL29175244 | 0.79 | TSHR (0.39) | ALDH1A1TSHRTHRBCES1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0663409-B1 | ANTIMICROBIAL POLYMER, CONTACT LENS, AND CONTACT LENS CARE PRODUCTS | NIPPON CHEMICAL IND (JP) | 1998-10-07 | — | — | EP | disclosed |
| US-5520910-A | PHOSPHONIUM VINYL SALT COPOLYMERS AS BACTERICIDES | NIPPON CHEMICAL INDUSTRIAL (JP) | 1996-05-28 | — | — | US | disclosed |
| EP-0663409-A1 | ANTIMICROBIAL POLYMER, CONTACT LENS, AND CONTACT LENS CARE PRODUCTS | NIPPON CHEMICAL INDUSTRIAL COMPANY LIMITED (JP) | 1995-07-19 | — | — | EP | disclosed |