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 | |
|---|---|---|---|---|
| ▸ | DNM1 | Q05193 | 3/20 | 0.46 |
| ▸ | GNAI3 | P08754 | 4/20 | 0.40 |
| ▸ | GNAO1 | P09471 | 4/20 | 0.40 |
| ▸ | GNAI1 | P63096 | 4/20 | 0.40 |
| ▸ | GUSB | P08236 | 2/20 | 0.39 |
| ▸ | EBP | Q15125 | 1/20 | 0.39 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
| ▸ | BCHE | P06276 | 1/20 | 0.36 |
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 SCHEMBL6903759 | 1.00 | DNM1 (0.46) | DNM1GNAI3GNAO1GNAI1GUSB | |
| SCHEMBL6375332 | 0.96 | DNM1 (0.50) | DNM1GNAI3GNAO1GNAI1GUSB | |
| SCHEMBL5358572 | 0.96 | DNM1 (0.50) | DNM1GNAI3GNAO1GNAI1GUSB | |
| Hydrochloric Acid SCHEMBL6905942 | 0.92 | DNM1 (0.52) | DNM1GNAI3GNAO1GNAI1GUSB | |
| Hydrochloric Acid SCHEMBL27578385 | 0.90 | DNM1 (0.41) | DNM1GNAI3GNAO1GNAI1GUSB | |
| SCHEMBL9551177 | 0.88 | DNM1 (0.56) | DNM1GNAI3GNAO1GNAI1GUSB | |
| SCHEMBL6379727 | 0.88 | DNM1 (0.56) | DNM1GNAI3GNAO1GNAI1GUSB | |
| SCHEMBL9551167 | 0.88 | DNM1 (0.56) | DNM1GNAI3GNAO1GNAI1GUSB | |
| Hydrochloric Acid SCHEMBL1072740 | 0.85 | GNAI3 (0.50) | GNAI3GNAO1GNAI1GUSBEBP | |
| Hydrochloric Acid SCHEMBL2232323 | 0.85 | GNAI3 (0.50) | GNAI3GNAO1GNAI1GUSBEBP |
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 |
|---|---|---|---|---|---|---|---|
| US-6803431-B1 | COMPLEX OF A TRANSITION METAL WITH A TRIDENTATE MACROCYCLIC LIGAND WHICH BEARS AT LEAST ONE SUBSTITUENT HAVING A DONOR FUNCTION AND AN ALUMINOXANE | BASF AKTIENGESELLSCHAFT (DE) | 2004-10-12 | — | — | US | disclosed |