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 | |
|---|---|---|---|---|
| ▸ | SLC6A3 known ✓ | Q01959 | 2/20 | 0.35 |
| ▸ | SLC6A2 known ✓ | P23975 | 1/20 | 0.35 |
| ▸ | ADRB2 known ✓ | P07550 | 1/20 | 0.34 |
| ▸ | ADRB1 known ✓ | P08588 | 1/20 | 0.34 |
| ▸ | ADRB3 known ✓ | P13945 | 1/20 | 0.34 |
| ▸ | SLC6A4 known ✓ | P31645 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 2/20 | 0.46 |
| ▸ | TP53 | P04637 | 1/20 | 0.46 |
| ▸ | PRKCA | P17252 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.44 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.38 |
| ▸ | LMNA | P02545 | 4/20 | 0.37 |
| ▸ | F2 | P00734 | 1/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.36 |
| ▸ | PDCD1 | Q15116 | 1/20 | 0.36 |
| ▸ | CD274 | Q9NZQ7 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.35 |
| ▸ | NPC1 | O15118 | 2/20 | 0.35 |
| ▸ | RAB9A | P51151 | 2/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL16271188 | 0.99 | TSHR (0.47) | TSHRTP53PRKCAALDH1A1CYP2D6 | |
| SCHEMBL2355030 | 0.99 | TSHR (0.47) | TSHRTP53PRKCAALDH1A1CYP2D6 | |
| SCHEMBL21798546 | 0.99 | TSHR (0.47) | TSHRTP53PRKCAALDH1A1CYP2D6 | |
| SCHEMBL2347962 | 0.94 | TSHR (0.49) | TSHRTP53PRKCAALDH1A1CYP2D6 | |
| SCHEMBL7149024 | 0.94 | TSHR (0.49) | TSHRTP53PRKCAALDH1A1CYP2D6 | |
| SCHEMBL27671082 | 0.94 | TSHR (0.49) | TSHRTP53PRKCAALDH1A1CYP2D6 | |
| SCHEMBL27671072 | 0.88 | TSHR (0.51) | TSHRTP53PRKCAALDH1A1CYP2D6 | |
| SCHEMBL19150118 | 0.86 | LMNA (0.41) | TSHRPRKCAALDH1A1CYP2D6LMNA | |
| SCHEMBL5371901 | 0.86 | CA12 (0.45) | TSHRPRKCAALDH1A1CYP2D6LMNA | |
| SCHEMBL23567079 | 0.83 | ALDH1A1 (0.41) | TSHRTP53PRKCAALDH1A1LMNA |
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 |
|---|---|---|---|---|---|---|---|
| EP-0721956-B1 | 21-SUBSTITUTED STEROID COMPOUND | NISSIN FOOD PRODUCTS LTD (JP) | 2000-08-02 | — | — | EP | disclosed |
| EP-0721956-A1 | 21-SUBSTITUTED STEROID COMPOUND | NISSIN SHOKUHIN KABUSHIKI KAISHA (JP) | 1996-07-17 | — | — | EP | disclosed |