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 | |
|---|---|---|---|---|
| ▸ | CHRM1 known ✓ | P11229 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 4/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.33 |
| ▸ | MAOA | P21397 | 1/20 | 0.33 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.33 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.33 |
| ▸ | HTR2B | P41595 | 1/20 | 0.33 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.32 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 3/20 | 0.31 |
| ▸ | GAA | P10253 | 3/20 | 0.31 |
| ▸ | MEN1 | O00255 | 2/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.31 |
| ▸ | TP53 | P04637 | 1/20 | 0.30 |
| ▸ | THRB | P10828 | 1/20 | 0.30 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.30 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.30 |
| ▸ | HPGD | P15428 | 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 | |
|---|---|---|---|---|
| Bromide SCHEMBL1306253 | 0.96 | MAPT (0.34) | MAPTCYP3A4CHRM1ALOX15MAOA | |
| Hydrochloric Acid SCHEMBL1306113 | 0.78 | RPS6KB2 (0.37) | MAPTLMNAGAAMEN1KMT2A | |
| Hydrochloric Acid SCHEMBL11452803 | 0.78 | TSHR (0.40) | MAPTCYP3A4LMNAMEN1KMT2A | |
| SCHEMBL218947 | 0.76 | TSHR (0.42) | MAPTLMNAMEN1KMT2AALDH1A1 | |
| Tiodonium SCHEMBL192767 | 0.73 | LMNA (0.36) | MAPTCYP3A4LMNAGAAMEN1 | |
| Hydrochloric Acid SCHEMBL192766 | 0.73 | RAB9A (0.36) | MAPTLMNAGAAMEN1KMT2A | |
| Hydrochloric Acid SCHEMBL11777898 | 0.73 | L3MBTL1 (0.38) | MAPTCYP3A4LMNAMEN1KMT2A | |
| Hydrochloric Acid SCHEMBL11776201 | 0.72 | KDM1A (0.35) | MAPTLMNAMEN1KMT2ATDP1 | |
| Tiodonium SCHEMBL2110688 | 0.71 | LMNA (0.37) | MAPTCYP3A4LMNAGAAMEN1 | |
| SCHEMBL1306575 | 0.70 | KDM1A (0.36) | MAPTALOX15LMNAMEN1KMT2A |
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-8053478-B1 | Antimicrobial diaryl iodonium compositions and method | Cornell Development Group, LLC (US) | 2011-11-08 | — | — | US | disclosed |