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 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ATM | Q13315 | 1/20 | 0.31 |
| ▸ | ESR1 | P03372 | 1/20 | 0.31 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 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 | |
|---|---|---|---|---|
| SCHEMBL15364389 | 0.96 | ESR1 (0.32) | ATMESR1ESR2CYP3A4TDP1 | |
| SCHEMBL15364391 | 0.96 | ESR1 (0.32) | ATMESR1ESR2CYP3A4TDP1 | |
| SCHEMBL5079908 | 0.94 | ESR1 (0.31) | ATMESR1ESR2CYP3A4TDP1 | |
| SCHEMBL27792155 | 0.89 | — | — | |
| Hydrochloric Acid SCHEMBL4457776 | 0.80 | KDM1A (0.39) | CYP3A4TDP1 | |
| Hydrochloric Acid SCHEMBL4456013 | 0.76 | ATM (0.33) | ATM | |
| SCHEMBL15364059 | 0.74 | GAA (0.38) | ATM | |
| SCHEMBL15364060 | 0.74 | GAA (0.38) | ATM | |
| Hydrochloric Acid SCHEMBL27719943 | 0.74 | CYP3A4 (0.37) | CYP3A4 | |
| SCHEMBL27792160 | 0.74 | PTGS2 (0.36) | ESR1TDP1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-101245084-B | Phosphine-substituted vinyl-containing metallocene catalyst, and preparation method and application thereof | PETROCHINA CO LTD | 2013-02-20 | — | — | CN | disclosed |
| US-7595413-B2 | Phosphine-substituted vinyl containing metallocene catalyst, preparation process and the application of the same | PETROCHINA COMPANY LIMITED (CN) | 2009-09-29 | — | — | US | disclosed |
| EP-1958969-A1 | A phosphine-substituted vinyl containing metallocene catalyst, preparation process and the application of the same | Petrochina Company Limited (CN) | 2008-08-20 | — | — | EP | disclosed |
| CN-101245084-A | Phosphine-substituted vinyl-containing metallocene catalyst, and preparation method and application thereof | PETROCHINA CO LTD (CN) | 2008-08-20 | — | — | CN | disclosed |
| US-20080194854-A1 | Phosphine-substituted vinyl containing metallocene catlyst, preparation process and the application of the same | PETROCHINA COMPANY LIMITED (CN) | 2008-08-14 | — | — | US | disclosed |
Patent text — is the patent's own abstract consistent with the prediction?
For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.
| Patent | Title | Text reads most about | Predicted target · text-rank |
|---|---|---|---|
| US-20080194854-A1 | Phosphine-substituted vinyl containing metallocene catlyst, preparation process and the application of the same | PI4K2B, PI4K2A, CPNE4 | ATM 1044/4885ESR1 1501/4885ESR2 1387/4885 |
“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.