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 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ABL1 | P00519 | 20/20 | 0.69 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.66 |
| ▸ | BCR | P11274 | 1/20 | 0.64 |
| ▸ | CRBN | Q96SW2 | 1/20 | 0.64 |
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 SCHEMBL30091102 | 1.00 | ABL1 (0.69) | ABL1KCNH2BCRCRBN | |
| Bromide SCHEMBL28902250 | 1.00 | ABL1 (0.69) | ABL1KCNH2BCRCRBN | |
| SCHEMBL22711583 | 0.99 | ABL1 (0.70) | ABL1KCNH2BCRCRBN | |
| SCHEMBL21477626 | 0.99 | ABL1 (0.70) | ABL1KCNH2BCRCRBN | |
| Hydrochloric Acid SCHEMBL28902253 | 0.98 | ABL1 (0.69) | ABL1KCNH2BCRCRBN | |
| Hydrochloric Acid SCHEMBL30091086 | 0.98 | ABL1 (0.69) | ABL1KCNH2BCRCRBN | |
| Hydrochloric Acid SCHEMBL28902254 | 0.98 | ABL1 (0.69) | ABL1KCNH2BCRCRBN | |
| SCHEMBL28902246 | 0.95 | ABL1 (0.66) | ABL1KCNH2BCRCRBN | |
| SCHEMBL30091177 | 0.95 | ABL1 (0.66) | ABL1KCNH2BCRCRBN | |
| SCHEMBL22711587 | 0.93 | ABL1 (0.80) | ABL1KCNH2BCRCRBN |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-117304171-A | Solid forms of pyrazine substituted nicotinamide, preparation and use thereof | 深圳市塔吉瑞生物医药有限公司 | 2023-12-29 | — | — | CN | disclosed |
| CN-115413277-B | Solid forms of pyrazine substituted nicotinamide, preparation and use thereof | 深圳市塔吉瑞生物医药有限公司 | 2023-08-01 | — | — | CN | disclosed |
| CN-115413277-A | Solid forms of pyrazine-substituted nicotinamide, their preparation and use | 深圳市塔吉瑞生物医药有限公司 | 2022-11-29 | — | — | CN | disclosed |