Known targets — ChEMBL curated mechanism
ABL1ADRA1AADRA1BADRA1DADRA2AADRA2BADRA2CADRB2AGTR1BCL2BCL2A1BCL2L1BCL2L10BCL2L2BCRBRAFCHRM1CHRNA10CHRNA9DRD1DRD2DRD3DRD4DRD5EGFRF2FLT1FLT4GCKGHSRGNRHRGRIN1GRIN2AGRIN2BGRIN2CGRIN2DGRIN3AGRIN3BHTR1AHTR1BHTR1DHTR2AHTR2CHTR3AIDH2KDRKITMAOBMCL1MTTPPP4HBPDGFRBPIK3CAPIK3CBPIK3CDPIK3CGPIK3R1PIK3R2PIK3R3PIK3R5PIKFYVEROCK1ROCK2SLC18A2SLC6A2SLC6A3SLC6A4TACR1TUBA1ATUBA1BTUBA1CTUBA3CTUBA3ETUBA4ATUBBTUBB1TUBB2ATUBB2BTUBB3TUBB4ATUBB4BTUBB6TUBB8gyrAgyrBparCparEpol
The experimentally established mechanism targets of None. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 2)
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 | |
|---|---|---|---|---|
| SCHEMBL27523351 | 0.83 | — | — | |
| Acetic Acid SCHEMBL5551531 | 0.80 | ALDH1A1 (0.33) | — | |
| Sulfuric Acid SCHEMBL28101970 | 0.75 | TP53 (0.31) | — | |
| SCHEMBL11235275 | 0.73 | CA1 (0.32) | CA1CA2 | |
| SCHEMBL28168718 | 0.71 | CA1 (0.34) | CA1CA2 | |
| N,N-Dimethylethanaminium SCHEMBL17385622 | 0.70 | CA2 (0.37) | CA1CA2 | |
| SCHEMBL28090390 | 0.70 | — | — | |
| SCHEMBL921047 | 0.69 | CA2 (0.40) | CA1CA2 | |
| SCHEMBL7478968 | 0.69 | — | — | |
| SCHEMBL11764612 | 0.69 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2007063327-A1 | HYDROXYLAMMONIUM SALTS AS IONIC LIQUIDS | BIONIQS LIMITED (GB) | 2007-06-07 | — | — | WO | disclosed |