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 | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.55 |
| ▸ | HTT | P42858 | 4/20 | 0.53 |
| ▸ | LMNA | P02545 | 3/20 | 0.52 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.52 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.47 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.46 |
| ▸ | HPGD | P15428 | 2/20 | 0.46 |
| ▸ | POLB | P06746 | 2/20 | 0.46 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.46 |
| ▸ | PKM | P14618 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.44 |
| ▸ | MEN1 | O00255 | 4/20 | 0.44 |
| ▸ | MAPT | P10636 | 4/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.43 |
| ▸ | NPC1 | O15118 | 1/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.43 |
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 SCHEMBL11570647 | 0.97 | TDP1 (0.55) | TDP1HTTLMNASMN1; SMN2PTGS2 | |
| SCHEMBL9082918 | 0.97 | TDP1 (0.58) | TDP1HTTLMNASMN1; SMN2PTGS2 | |
| SCHEMBL11430658 | 0.91 | TDP1 (0.53) | TDP1HTTLMNASMN1; SMN2PTGS2 | |
| Hydrochloric Acid SCHEMBL10949926 | 0.86 | HTT (0.55) | TDP1HTTLMNASMN1; SMN2PTGS2 | |
| Hydrochloric Acid SCHEMBL8501645 | 0.86 | HTT (0.58) | TDP1HTTLMNASMN1; SMN2PTGS2 | |
| Hydrochloric Acid SCHEMBL10955241 | 0.84 | HTT (0.57) | TDP1HTTLMNASMN1; SMN2PTGS2 | |
| Hydrochloric Acid SCHEMBL11387243 | 0.84 | HTT (0.57) | TDP1HTTLMNASMN1; SMN2PTGS2 | |
| SCHEMBL31139772 | 0.84 | HTT (0.60) | TDP1HTTLMNASMN1; SMN2PTGS2 | |
| SCHEMBL276717 | 0.84 | HTT (0.60) | TDP1HTTLMNASMN1; SMN2PTGS2 | |
| SCHEMBL29954832 | 0.81 | TDP1 (0.58) | TDP1HTTLMNASMN1; SMN2PTGS2 |
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 |
|---|---|---|---|---|---|---|---|
| US-4157892-A | COLORING AGENT IS CHEMICALLY COUPLED TO POLYMER | TOYO CONTACT LENS COMPANY, LIMITED (JP) | 1979-06-12 | — | — | US | claimed |
| US-4157892-A | COLORING AGENT IS CHEMICALLY COUPLED TO POLYMER | TOYO CONTACT LENS COMPANY, LIMITED (JP) | 1979-06-12 | — | — | US | disclosed |
| US-3933423-A | Azoic dyeing of leather | E. I. DU PONT DE NEMOURS AND COMPANY (US) | 1976-01-20 | — | — | US | disclosed |