Known targets — ChEMBL curated mechanism
ACHECHKACHRM1CHRM2CHRM3CHRM4CHRM5CHRNA1CHRNB1CHRNDCHRNECHRNGHRH2OPRM1
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 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 3/20 | 0.42 |
| ▸ | MEN1 | O00255 | 2/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.37 |
| ▸ | GRK2 | P25098 | 1/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.37 |
| ▸ | DNM1 | Q05193 | 4/20 | 0.37 |
| ▸ | ZDHHC20 | Q5W0Z9 | 1/20 | 0.35 |
| ▸ | ZDHHC2 | Q9UIJ5 | 1/20 | 0.35 |
| ▸ | ATM | Q13315 | 1/20 | 0.33 |
| ▸ | BBOX1 | O75936 | 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 | |
|---|---|---|---|---|
| SCHEMBL8428916 | 0.81 | ALDH1A1 (0.43) | KMT2AMEN1ALDH1A1CYP3A4CYP2C9 | |
| SCHEMBL8765940 | 0.81 | MEN1 (0.50) | KMT2AMEN1ALDH1A1CYP3A4CYP2C9 | |
| Bromide SCHEMBL6117348 | 0.80 | KMT2A (0.44) | KMT2AMEN1ALDH1A1CYP3A4CYP2C9 | |
| SCHEMBL36168 | 0.79 | ZDHHC20 (0.50) | KMT2AMEN1ALDH1A1CYP3A4CYP2C9 | |
| Ammonia Solution, Strong SCHEMBL28193830 | 0.79 | ALDH1A1 (0.44) | KMT2AMEN1ALDH1A1CYP3A4CYP2C9 | |
| SCHEMBL5713069 | 0.78 | ZDHHC20 (0.53) | KMT2AMEN1ALDH1A1CYP3A4CYP2C9 | |
| Bromide SCHEMBL9320690 | 0.78 | KMT2A (0.48) | KMT2AMEN1ALDH1A1CYP3A4CYP2C9 | |
| SCHEMBL9397033 | 0.78 | ZDHHC20 (0.53) | KMT2AMEN1ALDH1A1CYP3A4CYP2C9 | |
| SCHEMBL11760141 | 0.78 | ZDHHC20 (0.53) | KMT2AMEN1ALDH1A1CYP3A4CYP2C9 | |
| SCHEMBL4906709 | 0.77 | KMT2A (0.53) | KMT2AMEN1ALDH1A1CYP3A4CYP2C9 |
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 9 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6299866-B1 | FOR HAIR STYLING AND CONDITIONING | ISP INVESTMENTS INC. | 2001-10-09 | — | — | US | disclosed |
| EP-0805671-A4 | WATER-BASED, HAIR CARE PRODUCTS CONTAINING HOMOGENEOUS TERPOLYMERS HAVING BOTH HAIR STYLING AND CONDITIONING PROPERTIES | ISP INVESTMENTS INC (US) | 1999-02-10 | — | — | EP | disclosed |
| EP-0800540-A4 | HOMOGENEOUS TERPOLYMERS OF VINYL PYRROLIDONE, A QUATERNARY AMMONIUM MONOMER AND A HYDROPHOBIC MONOMER | ISP INVESTMENTS INC (US) | 1998-12-09 | — | — | EP | disclosed |
| EP-0805671-A1 | WATER-BASED, HAIR CARE PRODUCTS CONTAINING HOMOGENEOUS TERPOLYMERS HAVING BOTH HAIR STYLING AND CONDITIONING PROPERTIES | ISP INVESTMENTS INC. (US) | 1997-11-12 | — | — | EP | disclosed |
| EP-0800540-A1 | HOMOGENEOUS TERPOLYMERS OF VINYL PYRROLIDONE, A QUATERNARY AMMONIUM MONOMER AND A HYDROPHOBIC MONOMER | ISP INVESTMENTS INC. (US) | 1997-10-15 | — | — | EP | disclosed |
| WO-1996019966-A1 | WATER-BASED, HAIR CARE PRODUCTS CONTAINING HOMOGENEOUS TERPOLYMERS HAVING BOTH HAIR STYLING AND CONDITIONING PROPERTIES | ISP INVESTMENTS INC. (US) | 1996-07-04 | — | — | WO | disclosed |
| WO-1996020227-A1 | HOMOGENEOUS TERPOLYMERS OF VINYL PYRROLIDONE, A QUATERNARY AMMONIUM MONOMER AND A HYDROPHOBIC MONOMER | ISP INVESTMENTS INC. (US) | 1996-07-04 | — | — | WO | disclosed |
| US-5523369-A | HAIR STYLING, CONDITIONER COMPRISING A VINYL LACTAM, A QUATERNARY AMMONIUM MONOMER AND A HYDROPHOBIC MONOMER; ADSORPTION, WATER SOLUBILITY | ISP INVESTMENTS INC. (US) | 1996-06-04 | — | — | US | disclosed |
| US-5492988-A | POLYMERIZATION IN THE PRESENCE OF A RADICAL INITIATOR | ISP INVESTMENTS INC. (US) | 1996-02-20 | — | — | US | disclosed |