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 | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 3/20 | 0.86 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.86 |
| ▸ | CDC25B | P30305 | 3/20 | 0.86 |
| ▸ | MAOA | P21397 | 4/20 | 0.80 |
| ▸ | S100A4 | P26447 | 3/20 | 0.80 |
| ▸ | TDP2 | O95551 | 3/20 | 0.80 |
| ▸ | RAB9A | P51151 | 3/20 | 0.80 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.80 |
| ▸ | MAPT | P10636 | 3/20 | 0.80 |
| ▸ | APAF1 | O14727 | 2/20 | 0.80 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.80 |
| ▸ | LMNA | P02545 | 2/20 | 0.80 |
| ▸ | POLB | P06746 | 2/20 | 0.80 |
| ▸ | BLM | P54132 | 2/20 | 0.80 |
| ▸ | NPC1 | O15118 | 2/20 | 0.80 |
| ▸ | PLA2G1B | P04054 | 2/20 | 0.80 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.80 |
| ▸ | ATG4B | Q9Y4P1 | 2/20 | 0.80 |
| ▸ | PTPRC | P08575 | 2/20 | 0.80 |
| ▸ | CES2 | O00748 | 1/20 | 0.80 |
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 | |
|---|---|---|---|---|
| SCHEMBL28145725 | 0.96 | MEN1 (0.92) | MEN1KMT2ACDC25BMAOAS100A4 | |
| SCHEMBL29378679 | 0.96 | MEN1 (0.92) | MEN1KMT2ACDC25BMAOAS100A4 | |
| SCHEMBL31884 | 0.96 | MEN1 (0.92) | MEN1KMT2ACDC25BMAOAS100A4 | |
| Anthraquinone SCHEMBL9329779 | 0.96 | MEN1 (0.92) | MEN1KMT2ACDC25BMAOAS100A4 | |
| SCHEMBL20203661 | 0.96 | MEN1 (0.92) | MEN1KMT2ACDC25BMAOAS100A4 | |
| SCHEMBL30479684 | 0.96 | MEN1 (0.92) | MEN1KMT2ACDC25BMAOAS100A4 | |
| Water SCHEMBL7789828 | 0.93 | MEN1 (0.86) | MEN1KMT2ACDC25BMAOAS100A4 | |
| 9,10-Phenanthrenequinone SCHEMBL29746976 | 0.93 | S100A4 (0.93) | MEN1KMT2ACDC25BMAOAS100A4 | |
| SCHEMBL678825 | 0.93 | MEN1 (0.86) | MEN1KMT2ACDC25BMAOAS100A4 | |
| 9,10-Phenanthrenequinone SCHEMBL11634370 | 0.93 | S100A4 (0.93) | MEN1KMT2ACDC25BMAOAS100A4 |
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-106188037-A | A kind of compound based on 1,8-diaza-9-Fluorenone and application thereof | 中节能万润股份有限公司 | 2016-12-07 | — | — | CN | claimed |
| CN-106188037-A | A kind of compound based on 1,8-diaza-9-Fluorenone and application thereof | 中节能万润股份有限公司 | 2016-12-07 | — | — | CN | disclosed |