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 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH1 | P35367 | 2/20 | 0.58 |
| ▸ | CYP1A2 | P05177 | 4/20 | 0.50 |
| ▸ | HRH3 | Q9Y5N1 | 3/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.50 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.50 |
| ▸ | HRH4 | Q9H3N8 | 2/20 | 0.49 |
| ▸ | NAAA | Q02083 | 1/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.48 |
| ▸ | LMNA | P02545 | 1/20 | 0.48 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.48 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.48 |
| ▸ | MAPT | P10636 | 1/20 | 0.48 |
| ▸ | LIN28A | Q9H9Z2 | 1/20 | 0.48 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.48 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.46 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| Bromide SCHEMBL31367839 | 1.00 | HRH1 (0.58) | HRH1CYP1A2HRH3SMN1; SMN2CYP2C19 | |
| SCHEMBL5198431 | 0.98 | HRH1 (0.60) | HRH1CYP1A2HRH3SMN1; SMN2CYP2C19 | |
| Bromide SCHEMBL10378020 | 0.94 | HRH1 (0.61) | HRH1CYP1A2HRH3SMN1; SMN2CYP2C19 | |
| Bromide SCHEMBL7927416 | 0.92 | HRH1 (0.65) | HRH1CYP1A2HRH3SMN1; SMN2CYP2C19 | |
| SCHEMBL6551624 | 0.92 | HRH1 (0.63) | HRH1CYP1A2HRH3SMN1; SMN2CYP2C19 | |
| SCHEMBL7007425 | 0.90 | HRH1 (0.67) | HRH1CYP1A2HRH3SMN1; SMN2CYP2C19 | |
| SCHEMBL9670413 | 0.90 | HRH1 (0.67) | HRH1CYP1A2HRH3SMN1; SMN2CYP2C19 | |
| SCHEMBL28669182 | 0.90 | HRH1 (0.67) | HRH1CYP1A2HRH3SMN1; SMN2CYP2C19 | |
| SCHEMBL29145044 | 0.90 | HRH1 (0.67) | HRH1CYP1A2HRH3SMN1; SMN2CYP2C19 | |
| SCHEMBL29263622 | 0.90 | HRH1 (0.67) | HRH1CYP1A2HRH3SMN1; SMN2CYP2C19 |
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 9 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0348460-A4 | POLYCYCLICAMINES WITH PSYCHOTROPIC ACTIVITY | — | 1991-11-27 | — | — | EP | disclosed |
| US-4937347-A | Polycyclicamine with psychotropic activity | AMERICAN HOME PRODUCTS CORPORATION (US) | 1990-06-26 | — | — | US | disclosed |
| US-4927934-A | Polycyclicamine with psychotropic activity | AMERICAN HOME PRODUCTS CORPORATION (US) | 1990-05-22 | — | — | US | disclosed |
| EP-0348460-A1 | POLYCYCLICAMINES WITH PSYCHOTROPIC ACTIVITY | AMERICAN HOME PRODUCTS CORPORATION (US) | 1990-01-03 | — | — | EP | disclosed |
| US-4855430-A | Polycyclicamine with psychotropic activity | AMERICAN HOME PRODUCTS CORPORATION (US) | 1989-08-08 | — | — | US | disclosed |
| WO-1989004311-A1 | POLYCYCLICAMINES WITH PSYCHOTROPIC ACTIVITY | AMERICAN HOME PRODUCTS CORPORATION (US) | 1989-05-18 | — | — | WO | disclosed |
| US-4672117-A | Antipsychotic gamma-carbolines | AMERICAN HOME PRODUCTS CORPORATION (US) | 1987-06-09 | — | — | US | disclosed |
| EP-0223344-A1 | Gamma-carbolines | AMERICAN HOME PRODUCTS CORPORATION (US) | 1987-05-27 | — | — | EP | disclosed |
| US-4636563-A | Antipsychotic γ-carbolines | AMERICAN HOME PRODUCTS CORPORATION (US) | 1987-01-13 | — | — | US | disclosed |