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 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A3 known ✓ | Q01959 | 4/20 | 0.32 |
| ▸ | SLC6A4 known ✓ | P31645 | 3/20 | 0.32 |
| ▸ | SLC6A2 known ✓ | P23975 | 2/20 | 0.30 |
| ▸ | TSHR | P16473 | 2/20 | 0.36 |
| ▸ | USP2 | O75604 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | BLM | P54132 | 1/20 | 0.36 |
| ▸ | CACNA2D1 | P54289 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | DPP4 | P27487 | 1/20 | 0.31 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.31 |
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 SCHEMBL19205860 | 1.00 | TSHR (0.36) | TSHRUSP2ALDH1A1LMNACYP1A2 | |
| Bromide SCHEMBL19205858 | 1.00 | TSHR (0.36) | TSHRUSP2ALDH1A1LMNACYP1A2 | |
| SCHEMBL283331 | 0.97 | — | — | |
| SCHEMBL20987617 | 0.97 | TSHR (0.37) | TSHRUSP2ALDH1A1LMNACYP1A2 | |
| SCHEMBL8782198 | 0.97 | TSHR (0.37) | TSHRUSP2ALDH1A1LMNACYP1A2 | |
| SCHEMBL4351780 | 0.97 | TSHR (0.37) | TSHRUSP2ALDH1A1LMNACYP1A2 | |
| SCHEMBL11497564 | 0.97 | — | — | |
| SCHEMBL20987616 | 0.97 | TSHR (0.37) | TSHRUSP2ALDH1A1LMNACYP1A2 | |
| Hydrochloric Acid SCHEMBL15822234 | 0.94 | TSHR (0.36) | TSHRUSP2ALDH1A1LMNACYP1A2 | |
| Hydrochloric Acid SCHEMBL1141008 | 0.94 | TSHR (0.36) | TSHRUSP2ALDH1A1LMNACYP1A2 |
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 |
|---|---|---|---|---|---|---|---|
| US-9783896-B2 | Olea europaea subsp. cuspidate wood tar oil composition as an anticorrosive for metals in aqueous media | KING ABDULAZIZ UNIVERSITY (SA) | 2017-10-10 | — | — | US | disclosed |
| US-20170233873-A1 | OLEA EUROPAEA SUBSP. CUSPIDATE WOOD TAR OIL COMPOSITION AS AN ANTICORROSIVE FOR METALS IN AQUEOUS MEDIA. | KING ABDULAZIZ UNIVERSITY (SA) | 2017-08-17 | — | — | US | disclosed |