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 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC22A1 | O15245 | 3/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | SLC22A2 | O15244 | 1/20 | 0.35 |
| ▸ | DNM1 | Q05193 | 3/20 | 0.35 |
| ▸ | PSMD14 | O00487 | 1/20 | 0.34 |
| ▸ | PLA2G1B | P04054 | 1/20 | 0.34 |
| ▸ | MMP2 | P08253 | 1/20 | 0.34 |
| ▸ | RAD52 | P43351 | 1/20 | 0.34 |
| ▸ | ATG4B | Q9Y4P1 | 1/20 | 0.34 |
| ▸ | SPHK1 | Q9NYA1 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 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 | |
|---|---|---|---|---|
| SCHEMBL8500577 | 0.97 | SLC22A1 (0.43) | SLC22A1TSHRSLC22A2DNM1SPHK1 | |
| Bromide SCHEMBL3028711 | 0.95 | SLC22A1 (0.41) | SLC22A1TSHRSLC22A2DNM1SPHK1 | |
| Hydrochloric Acid SCHEMBL4603559 | 0.90 | DNM1 (0.48) | SLC22A1TSHRSLC22A2DNM1PLA2G1B | |
| Hydrochloric Acid SCHEMBL2772679 | 0.90 | DNM1 (0.48) | SLC22A1TSHRSLC22A2DNM1PLA2G1B | |
| Bromide SCHEMBL557385 | 0.85 | ALDH1A1 (0.52) | SLC22A1TSHRDNM1RAD52HSD17B10 | |
| Water SCHEMBL17222518 | 0.85 | SLC22A1 (0.48) | SLC22A1TSHRSLC22A2DNM1RAD52 | |
| Hydrochloric Acid SCHEMBL11582879 | 0.83 | TSHR (0.42) | SLC22A1TSHRHSD17B10 | |
| Hydrochloric Acid SCHEMBL315435 | 0.81 | DNM1 (0.44) | SLC22A1TSHRDNM1RAD52HSD17B10 | |
| SCHEMBL3850922 | 0.80 | TSHR (0.44) | SLC22A1TSHRHSD17B10 | |
| Hydrochloric Acid SCHEMBL2764924 | 0.80 | DNM1 (0.43) | SLC22A1TSHRDNM1HSD17B10 |
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-0824631-B1 | METHOD FOR INHIBITING THE PLUGGING OF CONDUITS BY GAS HYDRATES | SHELL INT RESEARCH (NL) | 1999-07-14 | — | — | EP | disclosed |
| EP-0824631-A1 | METHOD FOR INHIBITING THE PLUGGING OF CONDUITS BY GAS HYDRATES | SHELL INTERNATIONALE RESEARCHMAATSCHAPPIJ B.V. (NL) | 1998-02-25 | — | — | EP | disclosed |
| WO-1996034177-A1 | METHOD FOR INHIBITING THE PLUGGING OF CONDUITS BY GAS HYDRATES | SHELL INTERNATIONALE RESEARCH MAATSCHAPPIJ B.V. (NL) | 1996-10-31 | — | — | WO | disclosed |