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 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE4D | Q08499 | 12/20 | 0.40 |
| ▸ | PDE4B | Q07343 | 11/20 | 0.40 |
| ▸ | PDE4A | P27815 | 10/20 | 0.40 |
| ▸ | PDE4C | Q08493 | 10/20 | 0.40 |
| ▸ | NR1H4 | Q96RI1 | 2/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL8797605 | 1.00 | PDE4D (0.40) | PDE4DPDE4BPDE4APDE4CNR1H4 | |
| SCHEMBL8798426 | 0.99 | PDE4D (0.39) | PDE4DPDE4BPDE4APDE4CNR1H4 | |
| SCHEMBL8798358 | 0.99 | PDE4D (0.39) | PDE4DPDE4BPDE4APDE4CNR1H4 | |
| SCHEMBL6838034 | 0.94 | PDE4B (0.41) | PDE4DPDE4BPDE4APDE4C | |
| SCHEMBL6838036 | 0.94 | PDE4B (0.41) | PDE4DPDE4BPDE4APDE4C | |
| SCHEMBL5723083 | 0.93 | PDE4B (0.41) | PDE4DPDE4BPDE4APDE4C | |
| SCHEMBL5723090 | 0.93 | PDE4B (0.41) | PDE4DPDE4BPDE4APDE4C | |
| SCHEMBL5722952 | 0.86 | PDE4B (0.37) | PDE4DPDE4BPDE4APDE4C | |
| SCHEMBL5723009 | 0.85 | PDE4B (0.33) | PDE4DPDE4BPDE4APDE4CNR1H4 | |
| SCHEMBL5723017 | 0.85 | PDE4B (0.33) | PDE4DPDE4BPDE4APDE4CNR1H4 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0771794-A1 | OXYGEN-CONTAINING HETEROCYCLIC COMPOUNDS | KYOWA HAKKO KOGYO CO., LTD. (JP) | 1997-05-07 | — | — | EP | disclosed |