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 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.61 |
| ▸ | CYP11B1 | P15538 | 7/20 | 0.54 |
| ▸ | CYP11B2 | P19099 | 7/20 | 0.54 |
| ▸ | TNF | P01375 | 1/20 | 0.54 |
| ▸ | HTT | P42858 | 4/20 | 0.51 |
| ▸ | LMNA | P02545 | 4/20 | 0.51 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.51 |
| ▸ | TSHR | P16473 | 1/20 | 0.50 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.50 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.50 |
| ▸ | EGLN3 | Q9H6Z9 | 1/20 | 0.49 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.49 |
| ▸ | PKM | P14618 | 1/20 | 0.46 |
| ▸ | GGPS1 | O95749 | 1/20 | 0.46 |
| ▸ | FDPS | P14324 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL326813 | 0.98 | TDP1 (0.63) | TDP1CYP11B1CYP11B2TNFHTT | |
| Carbamic Acid SCHEMBL11602220 | 0.88 | EGLN3 (0.56) | TDP1CYP11B1CYP11B2TNFHTT | |
| SCHEMBL29881888 | 0.81 | TDP1 (0.70) | TDP1CYP11B1CYP11B2TNFHTT | |
| SCHEMBL9170274 | 0.81 | TDP1 (0.70) | TDP1CYP11B1CYP11B2TNFHTT | |
| SCHEMBL29958345 | 0.80 | TDP1 (0.63) | TDP1CYP11B1CYP11B2TNFHTT | |
| SCHEMBL7106613 | 0.80 | TDP1 (0.63) | TDP1CYP11B1CYP11B2TNFHTT | |
| SCHEMBL2140382 | 0.80 | TDP1 (0.63) | TDP1CYP11B1CYP11B2TNFHTT | |
| SCHEMBL9677151 | 0.78 | ALDH1A1 (0.47) | TDP1HTTLMNASMN1; SMN2 | |
| SCHEMBL28577879 | 0.78 | TDP1 (0.66) | TDP1CYP11B1CYP11B2TNFHTT | |
| SCHEMBL10891799 | 0.78 | MAPT (0.41) | TDP1CYP11B1CYP11B2TNFHTT |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4620871-A | SALTS OF PHTHALAZINES AND BENZIMIDAZOLES | ESZAKMAGYARORSZAGIVEGYIMUVEK (HU) | 1986-11-04 | — | — | US | disclosed |