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 | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 2/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.37 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.36 |
| ▸ | POLB | P06746 | 2/20 | 0.36 |
| ▸ | TUBB4A | P04350 | 1/20 | 0.36 |
| ▸ | TUBB | P07437 | 1/20 | 0.36 |
| ▸ | TUBA3C | P0DPH7 | 1/20 | 0.36 |
| ▸ | TUBA1B | P68363 | 1/20 | 0.36 |
| ▸ | TUBA4A | P68366 | 1/20 | 0.36 |
| ▸ | TUBB4B | P68371 | 1/20 | 0.36 |
| ▸ | TUBB3 | Q13509 | 1/20 | 0.36 |
| ▸ | TUBB2A | Q13885 | 1/20 | 0.36 |
| ▸ | TUBB8 | Q3ZCM7 | 1/20 | 0.36 |
| ▸ | TUBA3E | Q6PEY2 | 1/20 | 0.36 |
| ▸ | TUBA1A | Q71U36 | 1/20 | 0.36 |
| ▸ | TUBA1C | Q9BQE3 | 1/20 | 0.36 |
| ▸ | TUBB6 | Q9BUF5 | 1/20 | 0.36 |
| ▸ | TUBB2B | Q9BVA1 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL6572652 | 0.99 | CYP1A2 (0.38) | CYP1A2CYP2C9CYP2C19HSP90AA1ALDH1A1 | |
| Hydrochloric Acid SCHEMBL7629738 | 0.96 | HSP90AA1 (0.39) | CYP1A2CYP2C9CYP2C19HSP90AA1ALDH1A1 | |
| Hydrochloric Acid SCHEMBL6573111 | 0.89 | POLB (0.38) | CYP2C9CYP2C19HSP90AA1ALDH1A1POLB | |
| SCHEMBL6575606 | 0.88 | POLB (0.39) | CYP1A2CYP2C9CYP2C19ALDH1A1POLB | |
| Hydrochloric Acid SCHEMBL7638035 | 0.87 | POLB (0.40) | CYP1A2CYP2C9CYP2C19HSP90AA1ALDH1A1 | |
| Hydrochloric Acid SCHEMBL6942087 | 0.87 | CYP2C19 (0.38) | CYP1A2CYP2C9CYP2C19ALDH1A1TUBB4A | |
| SCHEMBL6939926 | 0.86 | CYP2C19 (0.39) | CYP1A2CYP2C9CYP2C19ALDH1A1TUBB4A | |
| Hydrochloric Acid SCHEMBL5526645 | 0.84 | HPGD (0.49) | CYP1A2CYP2C19HPGDKMT2AMEN1 | |
| Hydrochloric Acid SCHEMBL7632194 | 0.83 | ALDH1A1 (0.42) | CYP1A2CYP2C9CYP2C19ALDH1A1POLB | |
| Hydrochloric Acid SCHEMBL7635532 | 0.83 | POLB (0.39) | CYP1A2CYP2C9CYP2C19ALDH1A1POLB |
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-1066263-B1 | NOVEL CATIONIC 2-ACYLAMINOPHENOLS, THEIR USE AS COUPLER FOR OXIDATION DYEING, COMPOSITIONS CONTAINING THEM, AND DYEING METHODS | OREAL (FR) | 2004-05-26 | — | — | EP | claimed |
| US-6455737-B1 | CATIONIC DYES AND OXIDATION BASES HAVING INTENSE SHADES OR COLORS AND COLORFASTNESS USED ON HUMAN KERATIN FIBERS SUCH AS HAIR; MULTICOMPARTMENT KITS | L'OREAL S.A. (FR) | 2002-09-24 | — | — | US | claimed |
| US-6455737-B1 | CATIONIC DYES AND OXIDATION BASES HAVING INTENSE SHADES OR COLORS AND COLORFASTNESS USED ON HUMAN KERATIN FIBERS SUCH AS HAIR; MULTICOMPARTMENT KITS | L'OREAL S.A. (FR) | 2002-09-24 | — | — | US | disclosed |