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 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | F2 known ✓ | P00734 | 6/20 | 0.50 |
| ▸ | CHRM1 known ✓ | P11229 | 1/20 | 0.48 |
| ▸ | DRD2 known ✓ | P14416 | 1/20 | 0.48 |
| ▸ | ADRA2B known ✓ | P18089 | 1/20 | 0.48 |
| ▸ | ADRA2C known ✓ | P18825 | 1/20 | 0.48 |
| ▸ | SLC6A4 known ✓ | P31645 | 1/20 | 0.48 |
| ▸ | ADRA1A known ✓ | P35348 | 1/20 | 0.48 |
| ▸ | DRD3 known ✓ | P35462 | 1/20 | 0.48 |
| ▸ | HTR3A known ✓ | P46098 | 1/20 | 0.48 |
| ▸ | SLC6A3 known ✓ | Q01959 | 1/20 | 0.48 |
| ▸ | GHSR known ✓ | Q92847 | 1/20 | 0.48 |
| ▸ | FTO | Q9C0B1 | 1/20 | 0.59 |
| ▸ | F12 | P00748 | 12/20 | 0.53 |
| ▸ | PRSS1 | P07477 | 6/20 | 0.50 |
| ▸ | KLKB1 | P03952 | 4/20 | 0.50 |
| ▸ | F10 | P00742 | 3/20 | 0.50 |
| ▸ | KLK1 | P06870 | 3/20 | 0.50 |
| ▸ | C1R | P00736 | 2/20 | 0.50 |
| ▸ | PLG | P00747 | 5/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL7341905 | 0.94 | F12 (0.57) | FTOF12F2PRSS1KLKB1 | |
| SCHEMBL7348303 | 0.85 | FTO (0.62) | FTOF12F2PRSS1KLKB1 | |
| SCHEMBL10922456 | 0.83 | FTO (0.74) | FTOF12F2PRSS1KLKB1 | |
| SCHEMBL7336993 | 0.83 | FTO (0.62) | FTOF12F2PRSS1KLKB1 | |
| Nafamostat SCHEMBL29832433 | 0.82 | FTO (0.70) | FTOF12F2PRSS1KLKB1 | |
| Nafamostat SCHEMBL1568755 | 0.82 | FTO (0.70) | FTOF12F2PRSS1KLKB1 | |
| Nafamostat SCHEMBL564665 | 0.82 | FTO (0.70) | FTOF12F2PRSS1KLKB1 | |
| SCHEMBL7350024 | 0.80 | FTO (0.62) | FTOF12F2PRSS1KLKB1 | |
| SCHEMBL10699436 | 0.80 | CA2 (0.46) | PLGALDH1A1LMNAMAPTKDM4E | |
| SCHEMBL618825 | 0.79 | FTO (0.50) | FTOF12F2PRSS1KLKB1 |
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-0287036-A2 | New pharmaceutical compositions comprising esters or amides as active ingredients | ONO PHARMACEUTICAL CO., LTD. (JP) | 1988-10-19 | — | — | EP | disclosed |