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 | |
|---|---|---|---|---|
| ▸ | SLC10A2 known ✓ | Q12908 | 3/20 | 0.50 |
| ▸ | ACHE known ✓ | P22303 | 2/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | TUBB4A | P04350 | 1/20 | 0.41 |
| ▸ | TUBB | P07437 | 1/20 | 0.41 |
| ▸ | TUBA3C | P0DPH7 | 1/20 | 0.41 |
| ▸ | TUBA1B | P68363 | 1/20 | 0.41 |
| ▸ | TUBA4A | P68366 | 1/20 | 0.41 |
| ▸ | TUBB4B | P68371 | 1/20 | 0.41 |
| ▸ | TUBB3 | Q13509 | 1/20 | 0.41 |
| ▸ | TUBB2A | Q13885 | 1/20 | 0.41 |
| ▸ | TUBB8 | Q3ZCM7 | 1/20 | 0.41 |
| ▸ | TUBA3E | Q6PEY2 | 1/20 | 0.41 |
| ▸ | TUBA1A | Q71U36 | 1/20 | 0.41 |
| ▸ | TUBA1C | Q9BQE3 | 1/20 | 0.41 |
| ▸ | TUBB6 | Q9BUF5 | 1/20 | 0.41 |
| ▸ | TUBB2B | Q9BVA1 | 1/20 | 0.41 |
| ▸ | TUBB1 | Q9H4B7 | 1/20 | 0.41 |
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 SCHEMBL8492296 | 0.97 | SLC10A2 (0.47) | SLC10A2NPC1ALDH1A1GAATUBB4A | |
| Hydrochloric Acid SCHEMBL8496928 | 0.93 | GAA (0.44) | SLC10A2NPC1ALDH1A1GAAHTT | |
| Hydrochloric Acid SCHEMBL8136074 | 0.80 | SLC10A2 (0.52) | SLC10A2NPC1ALDH1A1GAATUBB4A | |
| Hydrochloric Acid SCHEMBL8131473 | 0.77 | SLC10A2 (0.49) | SLC10A2NPC1ALDH1A1GAATUBB4A | |
| SCHEMBL7824403 | 0.77 | GAA (0.64) | SLC10A2NPC1ALDH1A1GAATUBB4A | |
| SCHEMBL8132769 | 0.76 | SLC10A2 (0.56) | SLC10A2NPC1ALDH1A1GAATUBB4A | |
| SCHEMBL8132154 | 0.75 | SLC10A2 (0.55) | SLC10A2NPC1ALDH1A1GAATUBB4A | |
| SCHEMBL8133071 | 0.75 | SLC10A2 (0.55) | SLC10A2NPC1ALDH1A1GAATUBB4A | |
| Hydrochloric Acid SCHEMBL8492563 | 0.74 | WHR1 (0.54) | NPC1ALDH1A1MAPTMEN1LMNA | |
| Hydrochloric Acid SCHEMBL8494230 | 0.74 | SLC10A2 (0.49) | SLC10A2NPC1ALDH1A1GAATUBB4A |
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-5948782-A | ANTIINFLAMMATORY AGENT; RHEUMATIC DISEASES | TAKEDA CHEMICAL (JP) | 1999-09-07 | — | — | US | disclosed |
| US-5852039-A | Pharmaceutical composition containing quinoline or quinazoline derivatives | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 1998-12-22 | — | — | US | disclosed |
| US-5719157-A | OSTEOPOROSIS | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 1998-02-17 | — | — | US | disclosed |