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 | |
|---|---|---|---|---|
| ▸ | RAD52 | P43351 | 2/20 | 0.45 |
| ▸ | GAA | P10253 | 2/20 | 0.45 |
| ▸ | LGMN | Q99538 | 2/20 | 0.35 |
| ▸ | DPP4 | P27487 | 7/20 | 0.33 |
| ▸ | CDK1 | P06493 | 3/20 | 0.33 |
| ▸ | CDK2 | P24941 | 2/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.32 |
| ▸ | MAPT | P10636 | 2/20 | 0.32 |
| ▸ | THRB | P10828 | 1/20 | 0.32 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.31 |
| ▸ | HTT | P42858 | 1/20 | 0.31 |
| ▸ | RECQL | P46063 | 1/20 | 0.31 |
| ▸ | PTK2B | Q14289 | 1/20 | 0.31 |
| ▸ | HRH4 | Q9H3N8 | 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 | |
|---|---|---|---|---|
| SCHEMBL2927410 | 0.99 | RAD52 (0.46) | RAD52GAALGMNDPP4CDK1 | |
| Hydrochloric Acid SCHEMBL6494867 | 0.96 | RAD52 (0.46) | RAD52GAALGMNDPP4CDK1 | |
| Hydrochloric Acid SCHEMBL6401046 | 0.95 | GAA (0.44) | RAD52GAALGMNDPP4CDK1 | |
| Hydrochloric Acid SCHEMBL2535818 | 0.95 | GAA (0.44) | RAD52GAALGMNDPP4CDK1 | |
| SCHEMBL12370012 | 0.95 | RAD52 (0.43) | RAD52GAALGMNDPP4CDK1 | |
| SCHEMBL2930438 | 0.95 | RAD52 (0.47) | RAD52GAALGMNDPP4CDK1 | |
| SCHEMBL2266252 | 0.94 | GAA (0.45) | RAD52GAALGMNDPP4CDK1 | |
| SCHEMBL13515142 | 0.91 | GAA (0.40) | RAD52GAALGMNDPP4 | |
| Hydrochloric Acid SCHEMBL6714585 | 0.90 | GAA (0.42) | RAD52GAALGMNDPP4CDK1 | |
| Hydrochloric Acid SCHEMBL2540981 | 0.90 | RAD52 (0.41) | RAD52GAALGMNDPP4CDK1 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6923835-B2 | Bis-para-phenylenediamine derivatives comprising a pyrrolidyl group and use of these derivatives for dyeing keratin fibres | L'OREAL S.A. (FR) | 2005-08-02 | — | — | US | disclosed |