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 | |
|---|---|---|---|---|
| ▸ | ADRA2A | P08913 | 4/20 | 0.34 |
| ▸ | ADRA2B | P18089 | 2/20 | 0.34 |
| ▸ | ADRA2C | P18825 | 2/20 | 0.34 |
| ▸ | PDCD1 | Q15116 | 1/20 | 0.33 |
| ▸ | CD274 | Q9NZQ7 | 1/20 | 0.33 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.31 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.31 |
| ▸ | NPC1 | O15118 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | HPGD | P15428 | 1/20 | 0.31 |
| ▸ | TSHR | P16473 | 1/20 | 0.31 |
| ▸ | RAB9A | P51151 | 1/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.31 |
| ▸ | TNF | P01375 | 1/20 | 0.31 |
| ▸ | HTR7 | P34969 | 3/20 | 0.31 |
| ▸ | HTR2B | P41595 | 3/20 | 0.31 |
| ▸ | TMEM97 | Q5BJF2 | 3/20 | 0.31 |
| ▸ | HTR1A | P08908 | 2/20 | 0.31 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.31 |
| ▸ | ADRA1A | P35348 | 2/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL29366427 | 0.97 | PDCD1 (0.34) | ADRA2AADRA2BADRA2CPDCD1CD274 | |
| SCHEMBL61908 | 0.97 | PDCD1 (0.34) | ADRA2AADRA2BADRA2CPDCD1CD274 | |
| Dimethylamine SCHEMBL1453283 | 0.93 | TDO2 (0.33) | ADRA2AADRA2BADRA2CPDCD1CD274 | |
| SCHEMBL6056122 | 0.90 | PDCD1 (0.30) | PDCD1CD274 | |
| SCHEMBL1452295 | 0.90 | PDCD1 (0.30) | PDCD1CD274 | |
| SCHEMBL16683341 | 0.90 | PDCD1 (0.30) | PDCD1CD274 | |
| SCHEMBL7050759 | 0.89 | PDCD1 (0.35) | ADRA2AADRA2BADRA2CPDCD1CD274 | |
| SCHEMBL1452790 | 0.89 | MAPK1 (0.39) | NPC1ALDH1A1RAB9ASMN1; SMN2HTR7 | |
| SCHEMBL5838399 | 0.88 | PDK2 (0.31) | — | |
| SCHEMBL7053161 | 0.88 | PDCD1 (0.34) | ADRA2AADRA2BADRA2CPDCD1CD274 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2096126-A1 | SOLID CATALYST FOR OLEFIN POLYMERIZATION, OLEFIN POLYMERIZATION METHOD, AND OLEFIN POLYMER PARTICLE PRODUCED BY THE METHOD | Mitsui Chemicals, Inc. (JP) | 2009-09-02 | — | — | EP | disclosed |
| US-7247686-B2 | Solid cocatalyst component for olefin polymerization and catalyst system thereof | BASELL POLYOLEFINE GMBH (DE) | 2007-07-24 | — | — | US | disclosed |
| US-20050009689-A1 | Solid cocatalyst component for olefin polymerization and catalyst system thereof | SUNALLOMER LTD. (JP) | 2005-01-13 | — | — | US | disclosed |