Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C9 | P11712 | 3/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.50 |
| ▸ | GAA | P10253 | 1/20 | 0.50 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.50 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.46 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.45 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.45 |
| ▸ | HPGD | P15428 | 1/20 | 0.45 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.45 |
| ▸ | PDE2A | O00408 | 1/20 | 0.44 |
| ▸ | PDE1A | P54750 | 1/20 | 0.44 |
| ▸ | PDE1B | Q01064 | 1/20 | 0.44 |
| ▸ | PDE1C | Q14123 | 1/20 | 0.44 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | CASP1 | P29466 | 1/20 | 0.40 |
| ▸ | CASP7 | P55210 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL461786 | 0.81 | PDE2A (0.62) | KDM4ECYP1A2ALDH1A1HSD17B10CYP3A4 | |
| SCHEMBL22521943 | 0.81 | CYP2C9 (0.49) | CYP2C9KDM4EGAARXFP1CYP1A2 | |
| SCHEMBL1460835 | 0.79 | PDE1A (0.75) | CYP1A2HIF1ACYP3A4PDE2APDE1A | |
| SCHEMBL7095216 | 0.78 | POLB (0.55) | CYP2C9KDM4EGAARXFP1CYP1A2 | |
| SCHEMBL7475458 | 0.76 | PDE1A (0.59) | CYP2C9KDM4EGAARXFP1CYP1A2 | |
| SCHEMBL515533 | 0.75 | CYP3A4 (0.62) | CYP2C9KDM4ECYP1A2HIF1AALDH1A1 | |
| SCHEMBL5406879 | 0.75 | HPGD (0.56) | KDM4ECYP1A2HIF1AALDH1A1CYP3A4 | |
| SCHEMBL1462066 | 0.72 | PDE2A (0.46) | PDE2APDE1APDE1BPDE1C | |
| SCHEMBL24667119 | 0.71 | CYP2C9 (0.62) | CYP2C9KDM4EGAARXFP1CYP1A2 | |
| SCHEMBL7017824 | 0.71 | PDE2A (0.58) | CYP1A2HIF1ACYP3A4ALOX15PDE2A |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0799040-B1 | TRISUBSTITUTED THIOXANTHINES | EURO CELTIQUE SA (LU) | 2003-08-20 | — | — | EP | disclosed |
| US-6268373-B1 | ENZYME INHIBITORS | EURO-CELTIQUE S.A. (LU) | 2001-07-31 | — | — | US | disclosed |
| US-6248746-B1 | PHOSPHODIESTERASE (PDE-IV) INHIBITOR FOR TREATMENT OF ASTHMA, ALLERGIES, ATOPIC DISEASES AND RHINITIS | EURO-CELTIQUE S.A. (LU) | 2001-06-19 | — | — | US | disclosed |
| US-6025361-A | EFFECTIVE PDE IV INHIBITORS, ASTHMA | EURO-CELTIQUE, S.A. (LU) | 2000-02-15 | — | — | US | disclosed |
| US-5977119-A | Trisubstituted thioxanthines | EURO-CELTIQUE, S.A. (LU) | 1999-11-02 | — | — | US | disclosed |