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 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
| ▸ | ESR1 | P03372 | 1/20 | 0.38 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.38 |
| ▸ | NR1H2 | P55055 | 3/20 | 0.34 |
| ▸ | NR1H3 | Q13133 | 3/20 | 0.34 |
| ▸ | MGAM | O43451 | 2/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.31 |
| ▸ | TP53 | P04637 | 1/20 | 0.31 |
| ▸ | CA4 | P22748 | 1/20 | 0.31 |
| ▸ | BRD4 | O60885 | 1/20 | 0.30 |
| ▸ | BRD2 | P25440 | 1/20 | 0.30 |
| ▸ | LMNA | P02545 | 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 | |
|---|---|---|---|---|
| SCHEMBL40410 | 0.78 | MAPT (0.41) | MAPTESR1ESR2NR1H2NR1H3 | |
| SCHEMBL9217667 | 0.76 | MAPT (0.47) | MAPTESR1ESR2NR1H2NR1H3 | |
| SCHEMBL9226507 | 0.74 | MAPT (0.45) | MAPTESR1ESR2NR1H2NR1H3 | |
| SCHEMBL18084487 | 0.72 | MGAM (0.44) | MAPTESR1ESR2NR1H2NR1H3 | |
| SCHEMBL6833296 | 0.72 | MAPT (0.44) | MAPTESR1ESR2NR1H2NR1H3 | |
| SCHEMBL25284860 | 0.72 | MAPT (0.44) | MAPTESR1ESR2NR1H2NR1H3 | |
| SCHEMBL9712158 | 0.72 | MAPT (0.48) | MAPTESR1ESR2NR1H2NR1H3 | |
| SCHEMBL10523358 | 0.72 | MAPT (0.44) | MAPTESR1ESR2NR1H2NR1H3 | |
| SCHEMBL3614652 | 0.72 | MAPT (0.48) | MAPTESR1ESR2NR1H2NR1H3 | |
| SCHEMBL852172 | 0.72 | MAPT (0.44) | MAPTESR1ESR2NR1H2NR1H3 |
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 |
|---|---|---|---|---|---|---|---|
| US-4965380-A | Process for preparation of asymmetric triorganotin halide | NITTO KASEI CO., LTD. (JP) | 1990-10-23 | — | — | US | disclosed |
| EP-0361323-A2 | Process for the preparation of asymmetric triorganotin halide | Nitto Kasei Co., Ltd. (JP) | 1990-04-04 | — | — | EP | disclosed |