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 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRA1D | P25100 | 1/20 | 0.31 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.31 |
| ▸ | ADRA1B | P35368 | 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 | |
|---|---|---|---|---|
| SCHEMBL6473676 | 0.95 | ADRA1D (0.33) | ADRA1DADRA1AADRA1B | |
| SCHEMBL6478958 | 0.93 | ADRA1D (0.32) | ADRA1DADRA1AADRA1B | |
| Hydrochloric Acid SCHEMBL6939631 | 0.91 | ADRA1D (0.31) | ADRA1DADRA1AADRA1B | |
| SCHEMBL6939642 | 0.86 | — | — | |
| SCHEMBL619638 | 0.81 | — | — | |
| SCHEMBL8608609 | 0.80 | — | — | |
| SCHEMBL9014010 | 0.77 | — | — | |
| SCHEMBL7371243 | 0.76 | CXCR4 (0.31) | — | |
| SCHEMBL9860508 | 0.75 | ADRA1D (0.33) | ADRA1DADRA1AADRA1B | |
| SCHEMBL8581174 | 0.73 | CXCR4 (0.40) | ADRA1DADRA1AADRA1B |
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-6593142-B2 | Polymer undergoes a detectable color change upon exposure to a biogenic amine | THE JOHNS HOPKINS UNIVERSITY | 2003-07-15 | — | — | US | disclosed |
| US-20030100118-A1 | POLYMERIC FOOD SPOILAGE SENSOR | JOHNS HOPKINS UNIVERSITY, THE | 2003-05-29 | — | — | US | disclosed |