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 | |
|---|---|---|---|---|
| ▸ | ACHE known ✓ | P22303 | 3/20 | 0.33 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.47 |
| ▸ | NPC1 | O15118 | 3/20 | 0.45 |
| ▸ | RAB9A | P51151 | 3/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.45 |
| ▸ | MAPT | P10636 | 2/20 | 0.45 |
| ▸ | MEN1 | O00255 | 1/20 | 0.45 |
| ▸ | STAT3 | P40763 | 1/20 | 0.45 |
| ▸ | HTT | P42858 | 1/20 | 0.45 |
| ▸ | POLB | P06746 | 2/20 | 0.37 |
| ▸ | TERT | O14746 | 2/20 | 0.32 |
| ▸ | KDM4A | O75164 | 2/20 | 0.32 |
| ▸ | KDM2A | Q9Y2K7 | 2/20 | 0.32 |
| ▸ | CTDSP1 | Q9GZU7 | 1/20 | 0.31 |
| ▸ | TSHR | P16473 | 1/20 | 0.31 |
| ▸ | HRH1 | P35367 | 1/20 | 0.31 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| Bromide SCHEMBL29396763 | 0.96 | HDAC8 (0.53) | HDAC8KDM4ENPC1RAB9ASMN1; SMN2 | |
| Bromide SCHEMBL152532 | 0.96 | HDAC8 (0.53) | HDAC8KDM4ENPC1RAB9ASMN1; SMN2 | |
| Bromide SCHEMBL7942908 | 0.94 | HDAC8 (0.52) | HDAC8KDM4ENPC1RAB9ASMN1; SMN2 | |
| Bromide SCHEMBL7942910 | 0.94 | HDAC8 (0.52) | HDAC8KDM4ENPC1RAB9ASMN1; SMN2 | |
| Hydrochloric Acid SCHEMBL7942906 | 0.94 | HDAC8 (0.52) | HDAC8KDM4ENPC1RAB9ASMN1; SMN2 | |
| SCHEMBL29838155 | 0.94 | HDAC8 (0.55) | HDAC8KDM4ENPC1RAB9ASMN1; SMN2 | |
| SCHEMBL153132 | 0.94 | HDAC8 (0.55) | HDAC8KDM4ENPC1RAB9ASMN1; SMN2 | |
| Hydrochloric Acid SCHEMBL1171580 | 0.92 | HDAC8 (0.53) | HDAC8KDM4ENPC1RAB9ASMN1; SMN2 | |
| Iodide SCHEMBL10938374 | 0.92 | KDM4E (0.54) | HDAC8KDM4ENPC1RAB9ASMN1; SMN2 | |
| Styrene SCHEMBL11146068 | 0.83 | KDM4E (0.47) | HDAC8KDM4ENPC1RAB9ASMN1; SMN2 |
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 |
|---|---|---|---|---|---|---|---|
| CN-114096280-A | Therapeutic constructs for co-delivery of mitotic kinase inhibitors and immune checkpoint inhibitors | 俄勒冈健康与科学大学 | 2022-02-25 | — | — | CN | disclosed |
| CN-114096274-A | Immunotherapeutic constructs and methods of use thereof | 俄勒冈健康与科学大学 | 2022-02-25 | — | — | CN | disclosed |