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 | |
|---|---|---|---|---|
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.30 |
| ▸ | NPC1 | O15118 | 1/20 | 0.30 |
| ▸ | MAPT | P10636 | 1/20 | 0.30 |
| ▸ | RAB9A | P51151 | 1/20 | 0.30 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.30 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.30 |
| ▸ | TDP1 | Q9NUW8 | 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 | |
|---|---|---|---|---|
| SCHEMBL5148507 | 0.97 | HSP90AA1 (0.35) | HSP90AA1ALDH1A1KDM4ECYP1A2TDP1 | |
| SCHEMBL5148511 | 0.97 | HSP90AA1 (0.35) | HSP90AA1ALDH1A1KDM4ECYP1A2TDP1 | |
| Hydrochloric Acid SCHEMBL5148533 | 0.94 | HSP90AA1 (0.33) | HSP90AA1ALDH1A1CYP1A2 | |
| SCHEMBL16077910 | 0.86 | HSP90AA1 (0.38) | HSP90AA1ALDH1A1KDM4ECYP1A2MEN1 | |
| SCHEMBL3689607 | 0.83 | KDM4E (0.53) | HSP90AA1ALDH1A1KDM4EMEN1NPC1 | |
| SCHEMBL3689609 | 0.83 | KDM4E (0.53) | HSP90AA1ALDH1A1KDM4EMEN1NPC1 | |
| Hydrochloric Acid SCHEMBL1049917 | 0.80 | GRIN2D (0.40) | HSP90AA1ALDH1A1KDM4ECYP1A2MEN1 | |
| Hydrochloric Acid SCHEMBL1685878 | 0.80 | GRIN2D (0.40) | HSP90AA1ALDH1A1KDM4ECYP1A2MEN1 | |
| SCHEMBL15858695 | 0.79 | ALDH1A1 (0.39) | HSP90AA1ALDH1A1KDM4ECYP1A2MEN1 | |
| SCHEMBL15082906 | 0.79 | NOS1 (0.41) | HSP90AA1ALDH1A1KDM4EMEN1MAPT |
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-1379562-B1 | SUPPORTED OLEFIN POLYMERIZATION CATALYSTS | DU PONT (US) | 2007-08-29 | — | — | EP | disclosed |
| US-6900153-B2 | Supported olefin polymerization catalysts | E.I. DU PONT DE NEMOURS AND COMPANY (US) | 2005-05-31 | — | — | US | disclosed |
| US-20020187892-A1 | Supported olefin polymerization catalysts | E. I. DU PONT DE NEMOURS AND COMPANY | 2002-12-12 | — | — | US | disclosed |