Known targets — ChEMBL curated mechanism
ACHEBDKRB2CHRM1CHRM2CHRM3CHRNA1CHRNB1CHRNDCHRNECHRNGGUCY1A1GUCY1A2GUCY1B1GUCY1B2NAMPTPTAFRSLC10A2SLC6A2SLC6A3TACR1dacAdacBdacCftsImrcAmrcBmrdA
The experimentally established mechanism targets of Hydrochloric Acid. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL9320130 | 0.78 | ACHE (0.33) | — | |
| SCHEMBL10381279 | 0.76 | ACHE (0.31) | — | |
| SCHEMBL6233259 | 0.75 | MEN1 (0.33) | — | |
| SCHEMBL18709152 | 0.75 | TGFBR1 (0.35) | — | |
| Hydrochloric Acid SCHEMBL7863766 | 0.72 | MEN1 (0.33) | — | |
| Phosphonic Acid SCHEMBL2559975 | 0.69 | TGFBR1 (0.32) | — | |
| Bromide SCHEMBL7869132 | 0.67 | MEN1 (0.43) | — | |
| SCHEMBL17350285 | 0.66 | TGFBR1 (0.34) | — | |
| SCHEMBL16356915 | 0.66 | — | — | |
| SCHEMBL111595 | 0.65 | TGFBR1 (0.33) | — |
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 |