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 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRA1A known ✓ | P35348 | 20/20 | 0.73 |
| ▸ | ADRA1D known ✓ | P25100 | 11/20 | 0.73 |
| ▸ | ADRA1B known ✓ | P35368 | 10/20 | 0.73 |
| ▸ | ADRA2C known ✓ | P18825 | 4/20 | 0.53 |
| ▸ | ADRA2A known ✓ | P08913 | 3/20 | 0.53 |
| ▸ | ADRA2B known ✓ | P18089 | 1/20 | 0.48 |
| ▸ | MAOB known ✓ | P27338 | 1/20 | 0.48 |
| ▸ | MAOA | P21397 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL6366851 | 0.92 | ADRA1A (0.87) | ADRA1AADRA1DADRA1BADRA2CADRA2A | |
| SCHEMBL6368282 | 0.85 | ADRA1A (1.00) | ADRA1AADRA1DADRA1BADRA2CADRA2A | |
| Fumaric Acid SCHEMBL7518117 | 0.81 | ADRA1A (0.70) | ADRA1AADRA1DADRA1BADRA2CADRA2A | |
| Fumaric Acid SCHEMBL7518112 | 0.81 | ADRA1A (0.70) | ADRA1AADRA1DADRA1BADRA2CADRA2A | |
| SCHEMBL6367331 | 0.74 | ADRA1A (1.00) | ADRA1AADRA1DADRA1BADRA2CADRA2A | |
| SCHEMBL6366701 | 0.74 | ALDH1A1 (0.49) | ADRA1AADRA1DADRA1BMAOB | |
| SCHEMBL29976453 | 0.74 | ALDH1A1 (0.49) | ADRA1AADRA1DADRA1BMAOB | |
| Hydrochloric Acid SCHEMBL9655745 | 0.73 | ADRA2C (0.57) | ADRA1AADRA1DADRA1BADRA2CADRA2A | |
| Fumaric Acid SCHEMBL6366565 | 0.71 | ADRA1A (0.83) | ADRA1AADRA1DADRA1BADRA2CADRA2A | |
| Fumaric Acid SCHEMBL6366573 | 0.71 | ADRA1A (0.83) | ADRA1AADRA1DADRA1BADRA2CADRA2A |
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-1175406-A1 | IMIDAZOLINE DERIVATIVES AS ALPHA-1A ADRENOCEPTOR LIGANDS | GLAXO GROUP LIMITED (GB) | 2002-01-30 | — | — | EP | disclosed |
| WO-2000066563-A1 | IMIDAZOLINE DERIVATIVES AS ALPHA-1A ADRENOCEPTOR LIGANDS | GLAXO GROUP LIMITED (GB) | 2000-11-09 | — | — | WO | disclosed |