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 | |
|---|---|---|---|---|
| ▸ | CHRNB2 | P17787 | 1/20 | 0.36 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.36 |
| ▸ | GSK3B | P49841 | 1/20 | 0.34 |
| ▸ | RIPK2 | O43353 | 3/20 | 0.33 |
| ▸ | LCK | P06239 | 3/20 | 0.33 |
| ▸ | KDR | P35968 | 3/20 | 0.33 |
| ▸ | TGFBR1 | P36897 | 3/20 | 0.33 |
| ▸ | PDCD1 | Q15116 | 1/20 | 0.32 |
| ▸ | CD274 | Q9NZQ7 | 1/20 | 0.32 |
| ▸ | CXCR4 | P61073 | 1/20 | 0.30 |
| ▸ | PNMT | P11086 | 1/20 | 0.30 |
| ▸ | OPRM1 | P35372 | 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 | |
|---|---|---|---|---|
| SCHEMBL22887771 | 0.97 | CHRNB2 (0.38) | CHRNB2CHRNA4GSK3BRIPK2LCK | |
| Hydrochloric Acid SCHEMBL25335409 | 0.96 | CHRNB2 (0.37) | CHRNB2CHRNA4GSK3BRIPK2LCK | |
| SCHEMBL30793436 | 0.93 | CHRNB2 (0.35) | CHRNB2CHRNA4GSK3BRIPK2LCK | |
| SCHEMBL1684264 | 0.88 | PDCD1 (0.39) | CHRNB2CHRNA4GSK3BPDCD1CD274 | |
| SCHEMBL22831695 | 0.84 | PDCD1 (0.36) | CHRNB2CHRNA4PDCD1CD274CXCR4 | |
| SCHEMBL23653232 | 0.82 | CXCR4 (0.36) | CHRNB2CHRNA4PDCD1CD274CXCR4 | |
| Hydrochloric Acid SCHEMBL27033568 | 0.82 | PDCD1 (0.32) | PDCD1CD274CXCR4 | |
| SCHEMBL24535306 | 0.80 | HTR2A (0.42) | — | |
| SCHEMBL24535290 | 0.79 | PDCD1 (0.33) | PDCD1CD274CXCR4 | |
| SCHEMBL24535881 | 0.79 | BAZ2B (0.41) | PDCD1CD274CXCR4 |
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 |
|---|---|---|---|---|---|---|---|
| EP-4472980-A2 | QUINAZOLINE PAN-KRAS INHIBITORS | Mirati Therapeutics, Inc. (US) | 2024-12-11 | — | — | EP | disclosed |
| WO-2023150284-A2 | QUINAZOLINE PAN-KRAS INHIBITORS | Mirati Therapeutics, Inc. (US) | 2023-08-10 | — | — | WO | disclosed |