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 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LAP3 | P28838 | 8/20 | 0.75 |
| ▸ | ANPEP | P15144 | 8/20 | 0.75 |
| ▸ | ERAP2 | Q6P179 | 5/20 | 0.55 |
| ▸ | ERAP1 | Q9NZ08 | 4/20 | 0.55 |
| ▸ | ALPI | P09923 | 1/20 | 0.52 |
| ▸ | PKM | P14618 | 1/20 | 0.52 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.52 |
| ▸ | XIAP | P98170 | 1/20 | 0.52 |
| ▸ | SLC7A5 | Q01650 | 1/20 | 0.52 |
| ▸ | ACP3 | P15309 | 1/20 | 0.52 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL7529859 | 0.98 | LAP3 (0.78) | LAP3ANPEPERAP2ERAP1ALPI | |
| SCHEMBL7526774 | 0.98 | LAP3 (0.78) | LAP3ANPEPERAP2ERAP1ALPI | |
| Hydrochloric Acid SCHEMBL8693019 | 0.96 | LAP3 (0.75) | LAP3ANPEPERAP2ERAP1ALPI | |
| Hydrochloric Acid SCHEMBL8689730 | 0.96 | LAP3 (0.75) | LAP3ANPEPERAP2ERAP1ALPI | |
| Bromide SCHEMBL15397852 | 0.88 | LAP3 (0.96) | LAP3ANPEPERAP2ERAP1ALPI | |
| SCHEMBL8740148 | 0.86 | LAP3 (1.00) | LAP3ANPEPERAP2ERAP1ALPI | |
| SCHEMBL2375608 | 0.86 | LAP3 (1.00) | LAP3ANPEPERAP2ERAP1ALPI | |
| Dextroamphetamine SCHEMBL547496 | 0.76 | TAAR1 (0.76) | LAP3ANPEPALPIPKMPTGS1 | |
| L-Phenylalaninol SCHEMBL20271122 | 0.76 | LAP3 (0.63) | LAP3ANPEPERAP2ERAP1ALPI | |
| L-Phenylalaninol SCHEMBL28343751 | 0.76 | LAP3 (0.63) | LAP3ANPEPERAP2ERAP1ALPI |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0635021-B1 | PROCESS FOR PRODUCING DERIVATIVES OF BIS(AMINOMETHYL) PHOSPHINIC ACID | HOECHST AG (DE) | 1996-10-09 | — | — | EP | disclosed |
| US-5510504-A | Process for the preparation of derivatives of bis(amino-methyl) phosphinic acid | HOECHST AKTIENGESELLSCHAFT (DE) | 1996-04-23 | — | — | US | disclosed |
| EP-0635021-A1 | PROCESS FOR PRODUCING DERIVATIVES OF BIS(AMINOMETHYL) PHOSPHINIC ACID. | HOECHST AG (DE) | 1995-01-25 | — | — | EP | disclosed |
| WO-1993020086-A1 | PROCESS FOR PRODUCING DERIVATIVES OF BIS(AMINOMETHYL) PHOSPHINIC ACID | HOECHST AKTIENGESELLSCHAFT (DE) | 1993-10-14 | — | — | WO | disclosed |