Known targets — ChEMBL curated mechanism
ACHECHKACHRM1CHRM2CHRM3CHRM4CHRM5CHRNA1CHRNB1CHRNDCHRNECHRNGHRH2OPRM1
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 | |
|---|---|---|---|---|
| ▸ | ACHE known ✓ | P22303 | 3/20 | 0.45 |
| ▸ | TSHR | P16473 | 4/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.36 |
| ▸ | CA1 | P00915 | 2/20 | 0.36 |
| ▸ | CA2 | P00918 | 2/20 | 0.36 |
| ▸ | CA7 | P43166 | 2/20 | 0.36 |
| ▸ | CA9 | Q16790 | 2/20 | 0.36 |
| ▸ | ESR1 | P03372 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.33 |
| ▸ | CYP2A6 | P11509 | 2/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | CASP3 | P42574 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | SENP8 | Q96LD8 | 1/20 | 0.33 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.33 |
| ▸ | SENP6 | Q9GZR1 | 1/20 | 0.33 |
| ▸ | MGLL | Q99685 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL6449318 | 0.97 | — | — | |
| Hydrochloric Acid SCHEMBL8500724 | 0.95 | TSHR (0.45) | TSHRACHEALDH1A1CA1CA2 | |
| Fluoride SCHEMBL29234912 | 0.95 | TSHR (0.45) | TSHRACHEALDH1A1CA1CA2 | |
| Fluoride Ion SCHEMBL11601744 | 0.95 | TSHR (0.45) | TSHRACHEALDH1A1CA1CA2 | |
| Hydrochloric Acid SCHEMBL30199443 | 0.95 | TSHR (0.45) | TSHRACHEALDH1A1CA1CA2 | |
| Fluoride Ion SCHEMBL28323448 | 0.92 | TSHR (0.43) | TSHRACHEALDH1A1CA1CA2 | |
| SCHEMBL11522076 | 0.88 | ACHE (0.42) | TSHRACHEALDH1A1CA1CA2 | |
| SCHEMBL311285 | 0.88 | ACHE (0.39) | TSHRACHEALDH1A1CA1CA2 | |
| Ammonia Solution, Strong SCHEMBL29141774 | 0.86 | ACHE (0.41) | TSHRACHEALDH1A1CA1CA2 | |
| Fluoride Ion SCHEMBL27782185 | 0.86 | TSHR (0.38) | TSHRACHEALDH1A1CA1CA2 |
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-0746540-A1 | PREPARATION OF 4,6-DIAMINORESORCINOL THROUGH A BISAZOARYLRESORCINOL INTERMEDIATE | THE DOW CHEMICAL COMPANY (US) | 1996-12-11 | — | — | EP | disclosed |
| US-5453542-A | Preparation of 4,6-diaminoresorcinol through a bisazoarylresorcinol intermediate | THE DOW CHEMICAL COMPANY (US) | 1995-09-26 | — | — | US | disclosed |
| WO-1995023130-A1 | PREPARATION OF 4,6-DIAMINORESORCINOL THROUGH A BISAZOARYLRESORCINOL INTERMEDIATE | THE DOW CHEMICAL COMPANY (US) | 1995-08-31 | — | — | WO | disclosed |