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 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.42 |
| ▸ | TAAR1 | Q96RJ0 | 6/20 | 0.37 |
| ▸ | PTPN1 | P18031 | 2/20 | 0.34 |
| ▸ | APOBEC3G | Q9HC16 | 1/20 | 0.33 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.33 |
| ▸ | DPP4 | P27487 | 1/20 | 0.32 |
| ▸ | HSPA5 | P11021 | 1/20 | 0.32 |
| ▸ | CA2 | P00918 | 1/20 | 0.31 |
| ▸ | HTR2A | P28223 | 1/20 | 0.30 |
| ▸ | PNMT | P11086 | 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 | |
|---|---|---|---|---|
| SCHEMBL5141233 | 0.80 | LIPG (0.40) | TDP1TAAR1CA2 | |
| SCHEMBL5596024 | 0.79 | TDP1 (0.36) | TDP1PTPN1CA2 | |
| SCHEMBL29534868 | 0.79 | TDP1 (0.55) | TDP1TAAR1PTPN1APOBEC3GFFAR1 | |
| SCHEMBL31203 | 0.79 | TDP1 (0.55) | TDP1TAAR1PTPN1APOBEC3GFFAR1 | |
| SCHEMBL3344635 | 0.79 | LIPG (0.39) | TDP1TAAR1CA2 | |
| SCHEMBL8597025 | 0.77 | — | — | |
| Bromide SCHEMBL8602059 | 0.76 | TAAR1 (0.37) | TAAR1 | |
| SCHEMBL16775680 | 0.75 | TAAR1 (0.58) | TAAR1HTR2A | |
| SCHEMBL6875195 | 0.73 | TAAR1 (0.60) | TDP1TAAR1HTR2A | |
| SCHEMBL632593 | 0.73 | DPP4 (0.48) | TDP1TAAR1DPP4HTR2APNMT |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5958906-A | Phospholipid derivatives containing higher elements of the fifth main group | ASTA-MEDICA AKTIENGESELLSCHAFT (DE) | 1999-09-28 | — | — | US | disclosed |