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.
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 | |
|---|---|---|---|---|
| SCHEMBL722616 | 0.97 | — | — | |
| Bromide SCHEMBL19681460 | 0.72 | SMN1; SMN2 (0.52) | — | |
| SCHEMBL10719025 | 0.71 | ALDH1A1 (0.61) | — | |
| SCHEMBL67456 | 0.71 | — | — | |
| SCHEMBL586988 | 0.69 | CYP19A1 (0.34) | — | |
| SCHEMBL461605 | 0.69 | — | — | |
| Bromide SCHEMBL4433292 | 0.69 | RAB9A (1.00) | — | |
| SCHEMBL22290651 | 0.68 | MAPT (0.54) | — | |
| SCHEMBL10518144 | 0.68 | RAB9A (0.60) | — | |
| Hydrochloric Acid SCHEMBL20475963 | 0.67 | — | — |
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-3347018-A2 | INHIBITORS OF CYCLIN-DEPENDENT KINASES | Dana-Farber Cancer Institute, Inc. (US) | 2018-07-18 | — | — | EP | disclosed |
| WO-2017044858-A2 | INHIBITORS OF CYCLIN-DEPENDENT KINASES | DANA-FARBER CANCER INSTITUTE, INC. (US) | 2017-03-16 | — | — | WO | disclosed |