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 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LMNA | P02545 | 6/20 | 0.59 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.59 |
| ▸ | MAPT | P10636 | 6/20 | 0.50 |
| ▸ | MAPK1 | P28482 | 4/20 | 0.48 |
| ▸ | MEN1 | O00255 | 4/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.48 |
| ▸ | GMNN | O75496 | 3/20 | 0.48 |
| ▸ | NPSR1 | Q6W5P4 | 3/20 | 0.48 |
| ▸ | BLM | P54132 | 3/20 | 0.48 |
| ▸ | HSP90AA1 | P07900 | 2/20 | 0.48 |
| ▸ | NR1H4 | Q96RI1 | 2/20 | 0.48 |
| ▸ | GLA | P06280 | 1/20 | 0.48 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.48 |
| ▸ | CYP1A2 | P05177 | 4/20 | 0.46 |
| ▸ | TP53 | P04637 | 1/20 | 0.45 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.45 |
| ▸ | TSHR | P16473 | 1/20 | 0.45 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.45 |
| ▸ | HRH1 | P35367 | 1/20 | 0.39 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL28760186 | 0.98 | LMNA (0.56) | LMNASMN1; SMN2MAPTMAPK1MEN1 | |
| SCHEMBL27528807 | 0.98 | LMNA (0.56) | LMNASMN1; SMN2MAPTMAPK1MEN1 | |
| SCHEMBL4523555 | 0.82 | LMNA (0.54) | LMNASMN1; SMN2MAPTMAPK1MEN1 | |
| SCHEMBL3680644 | 0.82 | LMNA (0.54) | LMNASMN1; SMN2MAPTMAPK1MEN1 | |
| SCHEMBL8747863 | 0.82 | LMNA (0.39) | LMNASMN1; SMN2MAPTMAPK1MEN1 | |
| SCHEMBL5082339 | 0.82 | MEN1 (0.59) | MAPTMEN1KMT2ACYP1A2TP53 | |
| SCHEMBL9189329 | 0.82 | MEN1 (0.59) | MAPTMEN1KMT2ACYP1A2TP53 | |
| SCHEMBL8747889 | 0.82 | MEN1 (0.59) | MAPTMEN1KMT2ACYP1A2TP53 | |
| SCHEMBL9187836 | 0.82 | MEN1 (0.59) | MAPTMEN1KMT2ACYP1A2TP53 | |
| SCHEMBL5082341 | 0.82 | MEN1 (0.59) | MAPTMEN1KMT2ACYP1A2TP53 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5599978-A | ESTERIFICATION, ACYLATION | SIGMA-TAU INDUSTRIE FARMACEUTICHE RIUNITE S.P.A. (IT) | 1997-02-04 | — | — | US | disclosed |
| EP-0609643-B1 | Process for manufacturing L-(-)-carnitine from a waste product having opposite configuration | SIGMA TAU IND FARMACEUTI (IT) | 1996-07-24 | — | — | EP | disclosed |
| US-5532410-A | ESTERIFICATION | SIGMA-TAU INDUSTRIE FARMACEUTICHE RUINITE S.P.A. (IT) | 1996-07-02 | — | — | US | disclosed |
| US-5412113-A | Decyclization | SIGMA-TAU INDUSTRIE FARMACEUTICHE RIUNITE S.P.A. (IT) | 1995-05-02 | — | — | US | disclosed |
| EP-0609643-A1 | Process for manufacturing L-(-)-carnitine from a waste product having opposite configuration | Sigma-Tau Industrie Farmaceutiche Riunite S.p.A. (IT) | 1994-08-10 | — | — | EP | disclosed |