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 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.40 |
| ▸ | DNM1 | Q05193 | 4/20 | 0.36 |
| ▸ | CES2 | O00748 | 1/20 | 0.34 |
| ▸ | FAAH | O00519 | 1/20 | 0.34 |
| ▸ | THRA | P10827 | 1/20 | 0.34 |
| ▸ | THRB | P10828 | 1/20 | 0.34 |
| ▸ | EPHX1 | P07099 | 4/20 | 0.33 |
| ▸ | KDM5A | P29375 | 3/20 | 0.33 |
| ▸ | PHF8 | Q9UPP1 | 3/20 | 0.33 |
| ▸ | KDM4C | Q9H3R0 | 2/20 | 0.33 |
| ▸ | ZDHHC20 | Q5W0Z9 | 2/20 | 0.33 |
| ▸ | ZDHHC2 | Q9UIJ5 | 2/20 | 0.33 |
| ▸ | MGLL | Q99685 | 1/20 | 0.33 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL2744545 | 0.98 | TSHR (0.41) | TSHRDNM1CES2FAAHTHRA | |
| SCHEMBL28049819 | 0.85 | TGFBR1 (0.32) | — | |
| SCHEMBL9116946 | 0.83 | CA12 (0.42) | TSHRCES2FAAHTHRATHRB | |
| SCHEMBL27525063 | 0.81 | KDM4E (0.37) | — | |
| SCHEMBL28825757 | 0.77 | CA12 (0.37) | TSHR | |
| SCHEMBL2360595 | 0.77 | TSHR (0.37) | TSHRDNM1CES2FAAHTHRA | |
| SCHEMBL446847 | 0.74 | TSHR (0.36) | TSHRDNM1CES2FAAHTHRA | |
| SCHEMBL28029776 | 0.74 | TSHR (0.33) | TSHR | |
| Hydrochloric Acid SCHEMBL16857677 | 0.73 | TSHR (0.35) | TSHRDNM1CES2FAAHTHRA | |
| SCHEMBL3279930 | 0.72 | KDM5A (0.40) | TSHRDNM1FAAHTHRATHRB |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-108424762-B | Self-suspending proppant for hydraulic fracturing and preparation method thereof | 天津新翔油气技术有限公司 | 2020-08-21 | — | — | CN | disclosed |