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 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDCD1 | Q15116 | 1/20 | 0.33 |
| ▸ | CD274 | Q9NZQ7 | 1/20 | 0.33 |
| ▸ | EDNRB | P24530 | 1/20 | 0.32 |
| ▸ | EDNRA | P25101 | 1/20 | 0.32 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.31 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.31 |
| ▸ | HTR1A | P08908 | 2/20 | 0.31 |
| ▸ | HTR7 | P34969 | 2/20 | 0.31 |
| ▸ | HTR2B | P41595 | 2/20 | 0.31 |
| ▸ | TMEM97 | Q5BJF2 | 2/20 | 0.31 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.31 |
| ▸ | BRD4 | O60885 | 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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL6905728 | 0.82 | PDCD1 (0.34) | PDCD1CD274EDNRBEDNRACHRNB2 | |
| Hydrochloric Acid SCHEMBL6909996 | 0.80 | PDCD1 (0.36) | PDCD1CD274EDNRBEDNRA | |
| Hydrochloric Acid SCHEMBL6910219 | 0.79 | CD44 (0.32) | — | |
| Hydrochloric Acid SCHEMBL6908389 | 0.79 | GPR3 (0.32) | — | |
| Hydrochloric Acid SCHEMBL27516469 | 0.76 | PDCD1 (0.35) | PDCD1CD274EDNRBEDNRACHRNB2 | |
| Hydrochloric Acid SCHEMBL29216496 | 0.75 | PDCD1 (0.34) | PDCD1CD274EDNRBEDNRACHRNB2 | |
| Hydrochloric Acid SCHEMBL27499114 | 0.75 | PDCD1 (0.34) | PDCD1CD274EDNRBEDNRACHRNB2 | |
| SCHEMBL6911175 | 0.72 | PDCD1 (0.32) | PDCD1CD274EDNRBEDNRACHRNB2 | |
| Hydrochloric Acid SCHEMBL5689032 | 0.72 | PDCD1 (0.32) | PDCD1CD274EDNRBEDNRACHRNB2 | |
| Hydrochloric Acid SCHEMBL30785520 | 0.71 | PDCD1 (0.31) | PDCD1CD274EDNRBEDNRACHRNB2 |
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-6790917-B2 | POLYMERIZING A VINYL COMPOUND IN PRESENCE OF A CATALYST OBTAINED BY COMBINING ORGANOTRANSITION METAL COMPOUND, AN ALUMINUM COMPUND OR ALUMOXANE AND A BORON COMPOUND | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 2004-09-14 | — | — | US | disclosed |
| US-20020198340-A1 | Process for producing vinyl compound polymer | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 2002-12-26 | — | — | US | disclosed |