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 | |
|---|---|---|---|---|
| ▸ | MAOB | P27338 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 4/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.41 |
| ▸ | BACE1 | P56817 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 3/20 | 0.41 |
| ▸ | MEN1 | O00255 | 2/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.41 |
| ▸ | APEX1 | P27695 | 1/20 | 0.41 |
| ▸ | FERMT2 | Q96AC1 | 1/20 | 0.40 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.39 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.39 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.39 |
| ▸ | TAAR1 | Q96RJ0 | 2/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.39 |
| ▸ | PYGL | P06737 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 2/20 | 0.38 |
| ▸ | MAPT | P10636 | 2/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL3904069 | 0.83 | KDM4E (0.46) | MAOBTSHRBACE1MEN1KMT2A | |
| SCHEMBL5800488 | 0.74 | CHRM2 (0.62) | TSHRLMNATAAR1MAPK1GAA | |
| SCHEMBL25438610 | 0.73 | MEN1 (0.64) | CYP3A4CYP1A2LMNAMEN1KMT2A | |
| SCHEMBL20686492 | 0.72 | MAOB (0.50) | MAOBTSHRCYP3A4CYP1A2BACE1 | |
| SCHEMBL29077417 | 0.70 | CYP1A2 (0.47) | TSHRCYP3A4CYP1A2MEN1KMT2A | |
| SCHEMBL11883401 | 0.70 | PYGL (0.46) | MAOBMEN1KMT2APYGLGAA | |
| SCHEMBL10747461 | 0.70 | PYGL (0.56) | BACE1LMNAMEN1KMT2AHDAC1 | |
| SCHEMBL23097564 | 0.70 | FERMT2 (0.55) | CYP3A4CYP1A2KMT2AFERMT2TAAR1 | |
| SCHEMBL10845913 | 0.69 | KDM4E (0.51) | CYP1A2LMNAMEN1KMT2AHDAC1 | |
| SCHEMBL14308495 | 0.69 | TAAR1 (0.66) | MAOBTSHRCYP3A4CYP1A2NFKB1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4260749-A | HAIR DYES | L'OREAL (FR) | 1981-04-07 | — | — | US | disclosed |
| US-4204059-A | HAIR DYES | L'OREAL (FR) | 1980-05-20 | — | — | US | disclosed |
| US-4084052-A | HAIR DYES | L'OREAL (FR) | 1978-04-11 | — | — | US | disclosed |
| US-4023926-A | Diaminobenzoquinones in hair dye compositions | SOCIETE ANONYME DITE: L'OREAL (FR) | 1977-05-17 | — | — | US | disclosed |