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 | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.56 |
| ▸ | TSHR | P16473 | 1/20 | 0.56 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.55 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.55 |
| ▸ | ESR1 | P03372 | 4/20 | 0.48 |
| ▸ | ESR2 | Q92731 | 4/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.33 |
| ▸ | PSMD14 | O00487 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | TP53 | P04637 | 1/20 | 0.31 |
| ▸ | POLB | P06746 | 1/20 | 0.31 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL8035043 | 0.98 | ALDH1A1 (0.59) | ALDH1A1TSHRTDP1CYP3A4ESR1 | |
| SCHEMBL98719 | 0.98 | ALDH1A1 (0.59) | ALDH1A1TSHRTDP1CYP3A4ESR1 | |
| SCHEMBL4112398 | 0.98 | ALDH1A1 (0.59) | ALDH1A1TSHRTDP1CYP3A4ESR1 | |
| SCHEMBL31378105 | 0.95 | ALDH1A1 (0.56) | ALDH1A1TSHRTDP1CYP3A4ESR1 | |
| Styrene SCHEMBL626802 | 0.91 | ALDH1A1 (0.70) | ALDH1A1TSHRTDP1CYP3A4ESR1 | |
| Bromide SCHEMBL28665363 | 0.91 | ALDH1A1 (0.61) | ALDH1A1TSHRTDP1CYP3A4ESR1 | |
| SCHEMBL31150304 | 0.90 | ALDH1A1 (0.50) | ALDH1A1TSHRTDP1CYP3A4ESR1 | |
| Styrene SCHEMBL17332131 | 0.88 | ALDH1A1 (0.67) | ALDH1A1TSHRTDP1CYP3A4ESR1 | |
| Styrene SCHEMBL5588859 | 0.88 | ALDH1A1 (0.67) | ALDH1A1TSHRTDP1CYP3A4ESR1 | |
| Styrene SCHEMBL2907310 | 0.88 | ALDH1A1 (0.67) | ALDH1A1TSHRTDP1CYP3A4ESR1 |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0522456-B1 | Resin composition for thermosetting coating | MITSUI CHEMICALS INC (JP) | 1998-10-07 | — | — | EP | claimed |
| US-5369178-A | Acrylic acid copolymer, epoxy acrylate | MITSUI TOATSU CHEMICALS, INC. (JP) | 1994-11-29 | — | — | US | claimed |
| EP-0522456-A2 | Resin composition for thermosetting coating | MITSUI TOATSU CHEMICALS, Inc. (JP) | 1993-01-13 | — | — | EP | claimed |
| EP-0522456-B1 | Resin composition for thermosetting coating | MITSUI CHEMICALS INC (JP) | 1998-10-07 | — | — | EP | disclosed |
| US-5369178-A | Acrylic acid copolymer, epoxy acrylate | MITSUI TOATSU CHEMICALS, INC. (JP) | 1994-11-29 | — | — | US | disclosed |
| EP-0522456-A2 | Resin composition for thermosetting coating | MITSUI TOATSU CHEMICALS, Inc. (JP) | 1993-01-13 | — | — | EP | disclosed |