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 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.35 |
| ▸ | CTSK | P43235 | 12/20 | 0.35 |
| ▸ | SLC15A1 | P46059 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 2/20 | 0.33 |
| ▸ | CA1 | P00915 | 1/20 | 0.33 |
| ▸ | CA2 | P00918 | 1/20 | 0.33 |
| ▸ | FAAH | O00519 | 2/20 | 0.31 |
| ▸ | CNR1 | P21554 | 1/20 | 0.30 |
| ▸ | CNR2 | P34972 | 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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL4932417 | 0.80 | TSHR (0.47) | TSHRCTSKSLC15A1LMNACA1 | |
| Hydrochloric Acid SCHEMBL8410681 | 0.73 | TSHR (0.41) | TSHRCTSKCA1CA2 | |
| Hydrochloric Acid SCHEMBL10996894 | 0.73 | TGFBR1 (0.40) | TSHRCTSKCA1CA2 | |
| SCHEMBL2932266 | 0.71 | TSHR (0.42) | TSHRLMNA | |
| SCHEMBL8904967 | 0.71 | CYP3A4 (0.56) | TSHRLMNACA1CA2 | |
| SCHEMBL2930891 | 0.69 | TSHR (0.50) | TSHRLMNA | |
| SCHEMBL9300767 | 0.67 | ALDH1A1 (0.37) | TSHR | |
| SCHEMBL27597202 | 0.67 | TAS1R3 (0.45) | CTSKSLC15A1CA1CA2FAAH | |
| SCHEMBL9425044 | 0.67 | TSHR (0.61) | TSHRFAAH | |
| SCHEMBL13684163 | 0.67 | TSHR (0.33) | TSHRLMNA |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| JP-11049788-A | — | — | None | — | — | JP | disclosed |
| JP-H1149788-A | PHOSPHONIUM COMPOUND HAVING (METH)ACRYLOYL URETHANE BOND AND ITS PRODUCTION | NIPPON CHEM IND CO LTD | 1999-02-23 | — | — | JP | disclosed |