Known targets — ChEMBL curated mechanism
ABL1ADRA1AADRA1BADRA1DADRA2AADRA2BADRA2CADRB2AGTR1BCL2BCL2A1BCL2L1BCL2L10BCL2L2BCRBRAFCHRM1CHRNA10CHRNA9DRD1DRD2DRD3DRD4DRD5EGFRF2FLT1FLT4GCKGHSRGNRHRGRIN1GRIN2AGRIN2BGRIN2CGRIN2DGRIN3AGRIN3BHTR1AHTR1BHTR1DHTR2AHTR2CHTR3AIDH2KDRKITMAOBMCL1MTTPPP4HBPDGFRBPIK3CAPIK3CBPIK3CDPIK3CGPIK3R1PIK3R2PIK3R3PIK3R5PIKFYVEROCK1ROCK2SLC18A2SLC6A2SLC6A3SLC6A4TACR1TUBA1ATUBA1BTUBA1CTUBA3CTUBA3ETUBA4ATUBBTUBB1TUBB2ATUBB2BTUBB3TUBB4ATUBB4BTUBB6TUBB8gyrAgyrBparCparEpol
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 | |
|---|---|---|---|---|
| ▸ | FLT4 known ✓ | P35916 | 1/20 | 0.94 |
| ▸ | KDR known ✓ | P35968 | 1/20 | 0.53 |
| ▸ | ALK | Q9UM73 | 19/20 | 0.94 |
| ▸ | INSR | P06213 | 10/20 | 0.94 |
| ▸ | PTK2 | Q05397 | 3/20 | 0.94 |
| ▸ | NUAK1 | O60285 | 1/20 | 0.94 |
| ▸ | CHEK2 | O96017 | 1/20 | 0.94 |
| ▸ | FES | P07332 | 1/20 | 0.94 |
| ▸ | FER | P16591 | 1/20 | 0.94 |
| ▸ | FLT3 | P36888 | 1/20 | 0.94 |
| ▸ | MAPK8 | P45983 | 1/20 | 0.94 |
| ▸ | RPS6KA3 | P51812 | 1/20 | 0.94 |
| ▸ | TNK2 | Q07912 | 1/20 | 0.94 |
| ▸ | MAP4K2 | Q12851 | 1/20 | 0.94 |
| ▸ | PTK6 | Q13882 | 1/20 | 0.94 |
| ▸ | RPS6KA2 | Q15349 | 1/20 | 0.94 |
| ▸ | RPS6KA1 | Q15418 | 1/20 | 0.94 |
| ▸ | RPS6KA6 | Q9UK32 | 1/20 | 0.94 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.70 |
| ▸ | AURKB | Q96GD4 | 1/20 | 0.53 |
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 SCHEMBL17727897 | 1.00 | ALK (0.94) | ALKINSRPTK2NUAK1CHEK2 | |
| SCHEMBL2061702 | 0.97 | ALK (1.00) | ALKINSRPTK2NUAK1CHEK2 | |
| SCHEMBL2061951 | 0.97 | ALK (1.00) | ALKINSRPTK2NUAK1CHEK2 | |
| SCHEMBL29489148 | 0.97 | ALK (1.00) | ALKINSRPTK2NUAK1CHEK2 | |
| SCHEMBL15289007 | 0.97 | ALK (1.00) | ALKINSRPTK2NUAK1CHEK2 | |
| SCHEMBL2061706 | 0.97 | ALK (1.00) | ALKINSRPTK2NUAK1CHEK2 | |
| SCHEMBL2061896 | 0.90 | ALK (1.00) | ALKINSRPTK2NUAK1CHEK2 | |
| SCHEMBL885798 | 0.89 | ALK (1.00) | ALKINSRPTK2NUAK1CHEK2 | |
| SCHEMBL886126 | 0.89 | ALK (1.00) | ALKINSRPTK2NUAK1CHEK2 | |
| SCHEMBL16966030 | 0.88 | ALK (0.83) | ALKINSRPTK2NUAK1CHEK2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-4320153-A1 | METHODS FOR THE TREATMENT OF ANAPLASTIC LARGE CELL LYMPHOMA | INSERM (Institut National de la Santé et de la Recherche Médicale) (FR) | 2024-02-14 | — | — | EP | disclosed |
| WO-2022214681-A1 | METHODS FOR THE TREATMENT OF ANAPLASTIC LARGE CELL LYMPHOMA | INSERM (Institut National de la Santé et de la Recherche Médicale) (FR) | 2022-10-13 | — | — | WO | disclosed |