Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 4/20 | 0.61 |
| ▸ | CYP2D6 | P10635 | 4/20 | 0.61 |
| ▸ | CYP2C19 | P33261 | 4/20 | 0.61 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.48 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.48 |
| ▸ | CA2 | P00918 | 2/20 | 0.48 |
| ▸ | CES1 | P23141 | 2/20 | 0.46 |
| ▸ | MMP12 | P39900 | 1/20 | 0.44 |
| ▸ | MMP13 | P45452 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.44 |
| ▸ | HPGD | P15428 | 1/20 | 0.44 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.44 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.44 |
| ▸ | CASP1 | P29466 | 1/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.43 |
| ▸ | NPC1 | O15118 | 1/20 | 0.43 |
| ▸ | KDM1A | O60341 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | HTR1A | P08908 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL9422837 | 0.89 | CA2 (0.53) | CYP1A2CYP2D6CYP2C19CA2SMN1; SMN2 | |
| SCHEMBL577806 | 0.87 | CYP1A2 (0.76) | CYP1A2CYP2D6CYP2C19CYP3A4CYP2C9 | |
| (Chloromethyl)Benzene SCHEMBL4625090 | 0.86 | CYP2C19 (0.45) | CYP1A2CYP2D6CYP2C19CYP3A4CYP2C9 | |
| SCHEMBL29738636 | 0.85 | CYP1A2 (0.73) | CYP1A2CYP2D6CYP2C19CYP3A4CYP2C9 | |
| SCHEMBL7029336 | 0.81 | CYP2C19 (0.55) | CYP1A2CYP2D6CYP2C19CYP3A4CYP2C9 | |
| SCHEMBL11126863 | 0.76 | — | — | |
| SCHEMBL124719 | 0.76 | — | — | |
| SCHEMBL25141717 | 0.76 | CYP1A2 (0.61) | CYP1A2CYP2D6CYP2C19CYP3A4CYP2C9 | |
| SCHEMBL9180229 | 0.76 | CYP1A2 (0.61) | CYP1A2CYP2D6CYP2C19CYP3A4CYP2C9 | |
| SCHEMBL5975033 | 0.76 | CYP1A2 (0.61) | CYP1A2CYP2D6CYP2C19CYP3A4CYP2C9 |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20110071334-A1 | FOAMING DECONTAMINATING AQUEOUS SOLUTION | COMMISSARIAT A L'ENERGIE ATOMIQUE ET AUX ENERGIES ALTERNATIVES (FR) | 2011-03-24 | — | — | US | disclosed |
| US-20110071334-A1 | FOAMING DECONTAMINATING AQUEOUS SOLUTION | COMMISSARIAT A L'ENERGIE ATOMIQUE ET AUX ENERGIES ALTERNATIVES (FR) | 2011-03-24 | — | — | US | disclosed |
| US-20110071334-A1 | FOAMING DECONTAMINATING AQUEOUS SOLUTION | COMMISSARIAT A L'ENERGIE ATOMIQUE ET AUX ENERGIES ALTERNATIVES (FR) | 2011-03-24 | — | — | US | disclosed |
| US-6143088-A | A PHTHALAMIDOALKYL PERACID, AN ALKANEDIOIC PERACID OR SALTS AND A CATIONIC QUATERNARY AMMONIUM SURFACTANT; CLEANING WITHOUT DEGRADATION OF MATERIALS SOILED BY TOXIC AGENTS, SUCH AS ORGANOPHOSPHATES AND -SULFUR COMPOUNDS, E.G. VX, YPERITE | Etat Francais represented by the Delegue General pour l ' Armement (FR) | 2000-11-07 | — | — | US | disclosed |
| EP-0636124-A1 | 3,4-DIHYDRO-2H-1,2,4-BENZOTHIADIAZINE-1,1-DIOXIDE-3-CARBOXYLIC ACID DERIVATIVES, PREPARATION THEREOF AND DRUGS CONTAINING SAME | Aventis Pharma S.A. (FR) | 1995-02-01 | — | — | EP | disclosed |
| WO-1993021170-A1 | 3,4-DIHYDRO-2H-1,2,4-BENZOTHIADIAZINE-1,1-DIOXIDE-3-CARBOXYLIC ACID DERIVATIVES, PREPARATION THEREOF AND DRUGS CONTAINING SAME | RHONE-POULENC RORER S.A. (FR) | 1993-10-28 | — | — | WO | disclosed |