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 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP17A1 | P05093 | 1/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
| ▸ | CYP26A1 | O43174 | 1/20 | 0.38 |
| ▸ | MC4R | P32245 | 1/20 | 0.35 |
| ▸ | KDM5A | P29375 | 1/20 | 0.33 |
| ▸ | KDM5B | Q9UGL1 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 2/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | CASP1 | P29466 | 1/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.33 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.32 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.32 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.32 |
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 SCHEMBL8150974 | 1.00 | CYP17A1 (0.40) | CYP17A1CYP2D6CYP26A1MC4RKDM5A | |
| SCHEMBL8516718 | 0.98 | CYP2D6 (0.40) | CYP17A1CYP2D6CYP26A1MC4RKDM5A | |
| SCHEMBL6417725 | 0.98 | CYP2D6 (0.40) | CYP17A1CYP2D6CYP26A1MC4RKDM5A | |
| SCHEMBL6417722 | 0.98 | CYP2D6 (0.40) | CYP17A1CYP2D6CYP26A1MC4RKDM5A | |
| SCHEMBL30745623 | 0.92 | CYP17A1 (0.37) | CYP17A1CYP2D6CYP26A1MC4RMEN1 | |
| Oxalic Acid SCHEMBL20895674 | 0.87 | ALDH1A1 (0.36) | CYP17A1CYP2D6KDM5AKDM5BKMT2A | |
| Trifluoromethanesulfonic Acid SCHEMBL6500935 | 0.85 | KDM4E (0.34) | CYP17A1CYP2D6KDM4E | |
| Trifluoromethanesulfonic Acid SCHEMBL6500928 | 0.85 | KDM4E (0.34) | CYP17A1CYP2D6KDM4E | |
| SCHEMBL925000 | 0.77 | KMT2A (0.35) | CYP2D6MC4RMEN1KMT2AKDM4E | |
| SCHEMBL925004 | 0.77 | CYP2D6 (0.42) | CYP17A1CYP2D6CYP26A1MC4RMEN1 |
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-6025496-A | Process for preparing heterocyclic carbenes | CELANESE GMBH (DE) | 2000-02-15 | — | — | US | disclosed |