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 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.60 |
| ▸ | PPP5C | P53041 | 1/20 | 0.58 |
| ▸ | TKT | P29401 | 5/20 | 0.52 |
| ▸ | LMNA | P02545 | 2/20 | 0.52 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | PDE4D | Q08499 | 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 SCHEMBL1533810 | 0.84 | PPP5C (0.67) | TDP1PPP5CTKTLMNAHSP90AA1 | |
| SCHEMBL2512165 | 0.83 | PPP5C (0.68) | TDP1PPP5CTKTLMNAHSP90AA1 | |
| SCHEMBL31477791 | 0.80 | PPP5C (0.70) | TDP1PPP5CTKTLMNAHSP90AA1 | |
| Hydrochloric Acid SCHEMBL3908684 | 0.79 | PPP5C (0.64) | TDP1PPP5CTKTLMNAHSP90AA1 | |
| Hydrochloric Acid SCHEMBL4321297 | 0.78 | TDP1 (0.59) | TDP1PPP5CTKTLMNAHSP90AA1 | |
| Hydrochloric Acid SCHEMBL788235 | 0.78 | LMNA (0.67) | TDP1PPP5CTKTLMNAHSP90AA1 | |
| SCHEMBL4364375 | 0.77 | PPP5C (0.82) | TDP1PPP5CTKTLMNAHSP90AA1 | |
| Hydrochloric Acid SCHEMBL459651 | 0.77 | LMNA (0.66) | TDP1PPP5CTKTLMNAHSP90AA1 | |
| Monophosphothiamine SCHEMBL29733068 | 0.76 | TDP1 (0.98) | TDP1TKTLMNAHSP90AA1ALDH1A1 | |
| Monophosphothiamine SCHEMBL94443 | 0.76 | TDP1 (0.98) | TDP1TKTLMNAHSP90AA1ALDH1A1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1720976-B1 | METHOD AND DEVICE FOR THERMAL CONDITIONING OF A CELL | INSILICO BIOTECHNOLOGY AG (DE) | 2014-10-08 | — | — | EP | disclosed |
| EP-1720976-A1 | METHOD AND DEVICE FOR THERMAL CONDITIONING OF A CELL | Insilico Biotechnology Gmbh (DE) | 2006-11-15 | — | — | EP | disclosed |
| WO-2005083054-A1 | METHOD AND DEVICE FOR THERMAL CONDITIONING OF A CELL | INSILICO BIOTECHNOLOGY GMBH (DE) | 2005-09-09 | — | — | WO | disclosed |