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 | |
|---|---|---|---|---|
| ▸ | CHRM2 known ✓ | P08172 | 1/20 | 0.31 |
| ▸ | CHRM1 known ✓ | P11229 | 1/20 | 0.31 |
| ▸ | ACHE known ✓ | P22303 | 1/20 | 0.31 |
| ▸ | SLC22A1 | O15245 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.36 |
| ▸ | ATM | Q13315 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | CHRNB2 | P17787 | 2/20 | 0.32 |
| ▸ | CHRNB4 | P30926 | 2/20 | 0.32 |
| ▸ | CHRNA3 | P32297 | 2/20 | 0.32 |
| ▸ | CHRNA7 | P36544 | 2/20 | 0.32 |
| ▸ | CHRNA4 | P43681 | 2/20 | 0.32 |
| ▸ | DNM1 | Q05193 | 4/20 | 0.32 |
| ▸ | TSHR | P16473 | 2/20 | 0.32 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.32 |
| ▸ | KCNA1 | Q09470 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.31 |
| ▸ | KCNH2 | Q12809 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL17418306 | 0.98 | SLC22A1 (0.43) | SLC22A1KDM4EPMP22ATMALDH1A1 | |
| Iodide SCHEMBL29201292 | 0.95 | SLC22A1 (0.41) | SLC22A1KDM4EPMP22ATMALDH1A1 | |
| Bromide SCHEMBL29201369 | 0.95 | SLC22A1 (0.41) | SLC22A1KDM4EPMP22ATMALDH1A1 | |
| SCHEMBL16352881 | 0.93 | SLC22A1 (0.43) | SLC22A1KDM4EPMP22ATMALDH1A1 | |
| Hydrochloric Acid SCHEMBL29201318 | 0.87 | KDM4E (0.42) | KDM4EPMP22ATMALDH1A1CHRNB2 | |
| SCHEMBL16352885 | 0.85 | CHRNA7 (0.41) | KDM4EPMP22ATMALDH1A1CHRNB2 | |
| SCHEMBL16352865 | 0.85 | SLC22A1 (0.44) | SLC22A1ALDH1A1DNM1TSHRALOX15 | |
| Bicarbonate SCHEMBL29201350 | 0.84 | ALDH1A1 (0.35) | SLC22A1ALDH1A1CHRNB2CHRNB4CHRNA3 | |
| Acetic Acid Methyl Ester SCHEMBL28005603 | 0.82 | ALDH1A1 (0.42) | SLC22A1ALDH1A1CHRNB2CHRNB4CHRNA3 | |
| Iodide SCHEMBL29201397 | 0.82 | CHRNA7 (0.43) | KDM4EPMP22ATMALDH1A1CHRNB2 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-117813334-A | Onium salt, blocking agent dissociation catalyst for blocking isocyanate, blocked isocyanate composition containing blocking agent dissociation catalyst, thermosetting resin composition, cured product, and method for producing same | 广荣化学株式会社 | 2024-04-02 | — | — | CN | disclosed |