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 | |
|---|---|---|---|---|
| ▸ | HDAC3 | O15379 | 8/20 | 0.67 |
| ▸ | HDAC1 | Q13547 | 6/20 | 0.67 |
| ▸ | HDAC2 | Q92769 | 6/20 | 0.67 |
| ▸ | HDAC10 | Q969S8 | 5/20 | 0.67 |
| ▸ | HDAC8 | Q9BY41 | 4/20 | 0.67 |
| ▸ | HDAC6 | Q9UBN7 | 3/20 | 0.67 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.67 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.67 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.67 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.67 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.67 |
| ▸ | NCOR2 | Q9Y618 | 2/20 | 0.64 |
| ▸ | MAPT | P10636 | 8/20 | 0.51 |
| ▸ | NPC1 | O15118 | 5/20 | 0.50 |
| ▸ | RAB9A | P51151 | 5/20 | 0.50 |
| ▸ | GAA | P10253 | 1/20 | 0.50 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.50 |
| ▸ | ENPP2 | Q13822 | 1/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.49 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL10812025 | 0.99 | HDAC3 (0.68) | HDAC3HDAC1HDAC2HDAC10HDAC8 | |
| Bromide SCHEMBL10753076 | 0.88 | HDAC3 (0.65) | HDAC3HDAC1HDAC2HDAC10HDAC8 | |
| Bromide SCHEMBL10726966 | 0.87 | HDAC3 (0.69) | HDAC3HDAC1HDAC2HDAC10HDAC8 | |
| Bromide SCHEMBL10750014 | 0.87 | MAPT (0.55) | HDAC3HDAC1HDAC2HDAC10HDAC8 | |
| SCHEMBL10810745 | 0.87 | HDAC3 (0.66) | HDAC3HDAC1HDAC2HDAC10HDAC8 | |
| SCHEMBL11148430 | 0.86 | HDAC3 (0.70) | HDAC3HDAC1HDAC2HDAC10HDAC8 | |
| SCHEMBL10808170 | 0.86 | MAPT (0.53) | HDAC3HDAC1HDAC2HDAC10HDAC8 | |
| SCHEMBL3612694 | 0.84 | MAPT (0.67) | HDAC3HDAC1HDAC2HDAC10HDAC6 | |
| SCHEMBL11239265 | 0.83 | MAPT (0.57) | HDAC3HDAC1HDAC2HDAC10HDAC6 | |
| Bromide SCHEMBL10753066 | 0.83 | HDAC3 (0.57) | HDAC3HDAC1HDAC2HDAC10HDAC8 |
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 |
|---|---|---|---|---|---|---|---|
| US-4645841-A | ANTIULCER AGENTS | ISTITUTO DE ANGELI, S.P.A. (IT) | 1987-02-24 | — | — | US | disclosed |
| US-4548944-A | ANTIULCER, ANTISECRETORY AGENTS | ISTITUTO DE ANGELI S.P.A. (IT) | 1985-10-22 | — | — | US | disclosed |
| EP-0089730-A2 | Guanidino heterocyclicphenylamidines, processes for their preparation and their pharmaceutical use | ISTITUTO DE ANGELI S.p.A. (IT) | 1983-09-28 | — | — | EP | disclosed |