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 | 1/20 | 0.36 |
| ▸ | CYP4F2 | P78329 | 1/20 | 0.42 |
| ▸ | CYP4A11 | Q02928 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | GFER | P55789 | 1/20 | 0.41 |
| ▸ | PPIB | P23284 | 1/20 | 0.40 |
| ▸ | PPIA | P62937 | 1/20 | 0.40 |
| ▸ | PPID | Q08752 | 1/20 | 0.40 |
| ▸ | PPIG | Q13427 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 2/20 | 0.39 |
| ▸ | DHFR | P00374 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | NT5E | P21589 | 1/20 | 0.38 |
| ▸ | RECQL | P46063 | 1/20 | 0.37 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.37 |
| ▸ | PRSS1 | P07477 | 2/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL9510010 | 0.89 | ALDH1A1 (0.42) | CYP4F2CYP4A11ALDH1A1GAAGFER | |
| SCHEMBL7071058 | 0.81 | CYP4F2 (0.53) | CYP4F2CYP4A11ALDH1A1GAAGFER | |
| SCHEMBL1161121 | 0.80 | CYP4F2 (0.63) | CYP4F2CYP4A11ALDH1A1GAAGFER | |
| Hydrochloric Acid SCHEMBL6801556 | 0.78 | CYP4F2 (0.61) | CYP4F2CYP4A11ALDH1A1GAAGFER | |
| SCHEMBL4591174 | 0.74 | TSHR (0.62) | ALDH1A1GAACYP2C9TSHRDHFR | |
| SCHEMBL7996038 | 0.74 | CYP4F2 (0.56) | CYP4F2CYP4A11ALDH1A1GAAGFER | |
| SCHEMBL21887555 | 0.74 | PDE4B (0.46) | ALDH1A1TSHRDHFRSMN1; SMN2TDP1 | |
| SCHEMBL999003 | 0.74 | ALDH1A1 (0.42) | CYP4F2CYP4A11ALDH1A1GAAGFER | |
| SCHEMBL7896900 | 0.73 | CYP4F2 (0.42) | CYP4F2CYP4A11ALDH1A1GAAGFER | |
| SCHEMBL85523 | 0.73 | PPID (0.58) | CYP4F2CYP4A11ALDH1A1PPIBPPIA |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5423998-A | Bleaching agent for detergent | AUSIMONT S.R.L. (IT) | 1995-06-13 | — | — | US | disclosed |
| US-5294362-A | Bleach | AUSIMONT S.R.L. (IT) | 1994-03-15 | — | — | US | disclosed |
| US-5245075-A | Bleaching agents | AUSIMONT S.R.L. (IT) | 1993-09-14 | — | — | US | disclosed |