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 | |
|---|---|---|---|---|
| ▸ | FLT3 | P36888 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.43 |
| ▸ | HTT | P42858 | 2/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 3/20 | 0.39 |
| ▸ | NPC1 | O15118 | 3/20 | 0.39 |
| ▸ | RAB9A | P51151 | 3/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.38 |
| ▸ | LMNA | P02545 | 2/20 | 0.38 |
| ▸ | CCR1 | P32246 | 2/20 | 0.38 |
| ▸ | CCR5 | P51681 | 2/20 | 0.38 |
| ▸ | CCR8 | P51685 | 2/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | METAP1 | P53582 | 1/20 | 0.38 |
| ▸ | BLM | P54132 | 1/20 | 0.38 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.38 |
| ▸ | DOHH | Q9BU89 | 1/20 | 0.38 |
| ▸ | P4HTM | Q9NXG6 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL27961125 | 0.98 | FLT3 (0.45) | FLT3ALDH1A1HTTHSD17B10MAPT | |
| SCHEMBL22767893 | 0.78 | OPRM1 (0.45) | FLT3ALDH1A1HTTHSD17B10MAPT | |
| Dipyridyl SCHEMBL28503547 | 0.74 | KDM4E (0.70) | FLT3ALDH1A1HTTHSD17B10MAPT | |
| SCHEMBL2015813 | 0.73 | ALDH1A1 (0.50) | FLT3ALDH1A1HTTHSD17B10RAB9A | |
| SCHEMBL15142439 | 0.71 | HSP90AA1 (0.37) | FLT3ALDH1A1HTTHSD17B10LMNA | |
| SCHEMBL10603938 | 0.70 | NPC1 (0.40) | FLT3ALDH1A1HTTMAPTNPC1 | |
| SCHEMBL12533662 | 0.70 | OPRM1 (0.49) | ALDH1A1HTTHSD17B10MAPTNPC1 | |
| SCHEMBL3392695 | 0.70 | OPRM1 (0.49) | ALDH1A1HTTHSD17B10MAPTNPC1 | |
| SCHEMBL12533665 | 0.70 | OPRM1 (0.49) | ALDH1A1HTTHSD17B10MAPTNPC1 | |
| SCHEMBL12533655 | 0.70 | OPRM1 (0.49) | ALDH1A1HTTHSD17B10MAPTNPC1 |
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-106635141-B | A kind of method of adamantyl ionic liquid co-catalysis production gasoline alkylate | 中国科学院过程工程研究所 | 2018-09-07 | — | — | CN | disclosed |
| CN-106635141-A | Method for producing alkylation gasoline with assistant catalysis of adamantyl ion liquid | 中国科学院过程工程研究所 | 2017-05-10 | — | — | CN | disclosed |