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 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRIN1 | Q05586 | 12/20 | 0.51 |
| ▸ | GRIN2B | Q13224 | 12/20 | 0.51 |
| ▸ | NPC1 | O15118 | 1/20 | 0.43 |
| ▸ | TP53 | P04637 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
| ▸ | RAB9A | P51151 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL7806889 | 0.99 | GRIN1 (0.52) | GRIN1GRIN2BNPC1TP53TSHR | |
| Hydrochloric Acid SCHEMBL8479286 | 0.90 | GRIN1 (0.60) | GRIN1GRIN2BNPC1TP53TSHR | |
| SCHEMBL7806895 | 0.88 | GRIN1 (0.62) | GRIN1GRIN2BNPC1TP53TSHR | |
| SCHEMBL7813702 | 0.81 | GRIN1 (0.53) | GRIN1GRIN2BNPC1TP53TSHR | |
| SCHEMBL7807068 | 0.81 | GRIN1 (0.56) | GRIN1GRIN2BNPC1TP53TSHR | |
| SCHEMBL7808653 | 0.81 | GRIN1 (0.56) | GRIN1GRIN2BNPC1TP53TSHR | |
| SCHEMBL7806900 | 0.81 | GRIN1 (0.56) | GRIN1GRIN2BNPC1TP53TSHR | |
| SCHEMBL7808790 | 0.81 | GRIN1 (0.56) | GRIN1GRIN2BNPC1TP53TSHR | |
| Hydrochloric Acid SCHEMBL8474413 | 0.80 | GRIN1 (0.55) | GRIN1GRIN2BNPC1TP53TSHR | |
| SCHEMBL7808614 | 0.77 | GRIN1 (0.52) | GRIN1GRIN2BNPC1TP53TSHR |
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-5972968-A | INTERLEUKIN INHIBITOR | ADIR ET COMPAGNIE (FR) | 1999-10-26 | — | — | US | disclosed |