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.
Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A2 known ✓ | P23975 | 1/20 | 0.34 |
| ▸ | PGR | P06401 | 1/20 | 0.42 |
| ▸ | PNMT | P11086 | 1/20 | 0.42 |
| ▸ | NPC1 | O15118 | 3/20 | 0.41 |
| ▸ | RAB9A | P51151 | 3/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.38 |
| ▸ | MAPT | P10636 | 2/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | MAOA | P21397 | 2/20 | 0.35 |
| ▸ | CA1 | P00915 | 1/20 | 0.35 |
| ▸ | CA2 | P00918 | 1/20 | 0.35 |
| ▸ | CA4 | P22748 | 1/20 | 0.35 |
| ▸ | CA6 | P23280 | 1/20 | 0.35 |
| ▸ | MAP3K9 | P80192 | 1/20 | 0.35 |
| ▸ | MAP3K11 | Q16584 | 1/20 | 0.35 |
| ▸ | HTR2B | P41595 | 3/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL29413832 | 0.81 | PNMT (0.47) | PGRPNMTNPC1RAB9AALDH1A1 | |
| SCHEMBL358531 | 0.81 | PNMT (0.47) | PGRPNMTNPC1RAB9AALDH1A1 | |
| Fluorene SCHEMBL28414270 | 0.79 | PNMT (0.46) | PGRPNMTNPC1RAB9AALDH1A1 | |
| Ammonia Solution, Strong SCHEMBL28142719 | 0.79 | PNMT (0.46) | PGRPNMTNPC1RAB9AALDH1A1 | |
| Hydrochloric Acid SCHEMBL8163953 | 0.79 | MAP3K9 (0.40) | PGRPNMTNPC1RAB9AALDH1A1 | |
| Hydrochloric Acid SCHEMBL28795030 | 0.79 | NPC1 (0.44) | PGRPNMTNPC1RAB9AALDH1A1 | |
| Hydrochloric Acid SCHEMBL27407138 | 0.79 | PGR (0.42) | PGRPNMTNPC1RAB9AALDH1A1 | |
| Methyl Alcohol SCHEMBL14815698 | 0.78 | NPC1 (0.46) | PGRPNMTNPC1RAB9AALDH1A1 | |
| Hydrochloric Acid SCHEMBL1116210 | 0.77 | PGR (0.41) | PGRPNMTNPC1RAB9AALDH1A1 | |
| Hydrochloric Acid SCHEMBL5355300 | 0.77 | PGR (0.41) | PGRPNMTNPC1RAB9AALDH1A1 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1520862-B1 | Butadiene polymer, and process for producing conjugated diene polymer | AGENCY IND SCIENCE TECHN (JP) | 2008-05-28 | — | — | EP | disclosed |
| EP-1520862-A2 | Butadiene polymer, and process for producing conjugated diene polymer | JAPAN as Represented by DIRECTOR GENERAL OF AGENCY OF INDUSTRIAL SCIENCE AND TECHNOLOGY (JP) | 2005-04-06 | — | — | EP | disclosed |
| EP-1054026-B1 | BUTADIENE POLYMERS AND PROCESS FOR PRODUCING CONJUGATED DIENE POLYMERS | JP AGENCY OF INDUSTRIALSCIENCE (JP) | 2004-12-08 | — | — | EP | disclosed |
| US-6653430-B1 | Addition polymerizing in presence of Group 4 metal complex having cyclopentadienyl structure and alumoxane cocatalyst; high cis configuration | JAPAN AS REPRESENTED BY DIRECTOR GENERAL OF THE AGENCY OF INDUSTRIAL SCIENCE AND TECHNOLOGY (JP) | 2003-11-25 | — | — | US | disclosed |
| EP-1054026-A1 | BUTADIENE POLYMERS AND PROCESS FOR PRODUCING CONJUGATED DIENE POLYMERS | JAPAN as Represented by DIRECTOR GENERAL OF AGENCY OF INDUSTRIAL SCIENCE AND TECHNOLOGY (JP) | 2000-11-22 | — | — | EP | disclosed |