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 | |
|---|---|---|---|---|
| ▸ | ADRA1A known ✓ | P35348 | 1/20 | 0.62 |
| ▸ | SLC6A2 known ✓ | P23975 | 2/20 | 0.56 |
| ▸ | SLC6A4 known ✓ | P31645 | 1/20 | 0.56 |
| ▸ | ADRB2 known ✓ | P07550 | 1/20 | 0.51 |
| ▸ | ADRB1 known ✓ | P08588 | 1/20 | 0.51 |
| ▸ | ADRA2A known ✓ | P08913 | 1/20 | 0.51 |
| ▸ | ADRA2B known ✓ | P18089 | 1/20 | 0.51 |
| ▸ | ADRA2C known ✓ | P18825 | 1/20 | 0.51 |
| ▸ | ADRA1D known ✓ | P25100 | 1/20 | 0.51 |
| ▸ | TDP1 | Q9NUW8 | 11/20 | 0.68 |
| ▸ | KDM4E | B2RXH2 | 10/20 | 0.68 |
| ▸ | HSD17B10 | Q99714 | 8/20 | 0.68 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.68 |
| ▸ | HPGD | P15428 | 4/20 | 0.68 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.68 |
| ▸ | GRM1 | Q13255 | 3/20 | 0.68 |
| ▸ | MEN1 | O00255 | 3/20 | 0.68 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.68 |
| ▸ | GRM2 | Q14416 | 2/20 | 0.68 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.68 |
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 | |
|---|---|---|---|---|
| SCHEMBL3478437 | 0.98 | TDP1 (0.70) | TDP1KDM4EHSD17B10ALDH1A1HPGD | |
| SCHEMBL10723439 | 0.98 | TDP1 (0.70) | TDP1KDM4EHSD17B10ALDH1A1HPGD | |
| SCHEMBL449665 | 0.98 | TDP1 (0.70) | TDP1KDM4EHSD17B10ALDH1A1HPGD | |
| Bromide SCHEMBL15743213 | 0.83 | HSD17B10 (0.62) | TDP1KDM4EHSD17B10ALDH1A1HPGD | |
| Bromide SCHEMBL15743212 | 0.83 | HSD17B10 (0.62) | TDP1KDM4EHSD17B10ALDH1A1HPGD | |
| SCHEMBL10721569 | 0.82 | TDP1 (0.55) | TDP1KDM4EHSD17B10ALDH1A1HPGD | |
| SCHEMBL11926758 | 0.82 | TDP1 (0.55) | TDP1KDM4EHSD17B10ALDH1A1HPGD | |
| SCHEMBL12648356 | 0.81 | ALDH1A1 (1.00) | TDP1KDM4EHSD17B10ALDH1A1HPGD | |
| SCHEMBL12648678 | 0.81 | ALDH1A1 (1.00) | TDP1KDM4EHSD17B10ALDH1A1HPGD | |
| SCHEMBL12648353 | 0.81 | ALDH1A1 (1.00) | TDP1KDM4EHSD17B10ALDH1A1HPGD |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4061862-A | ANTIBIOTIC | BRISTOL-MYERS COMPANY (US) | 1977-12-06 | — | — | US | disclosed |
| US-4026888-A | ANTIBIOTICS, BACTERICIDES | BRISTOL-MYERS COMPANY (US) | 1977-05-31 | — | — | US | disclosed |