Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE2A | O00408 | 2/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.32 |
| ▸ | TXNRD1 | Q16881 | 1/20 | 0.32 |
| ▸ | TXNRD3 | Q86VQ6 | 1/20 | 0.32 |
| ▸ | TXNRD2 | Q9NNW7 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.30 |
| ▸ | MAPT | P10636 | 1/20 | 0.30 |
| ▸ | HTT | P42858 | 1/20 | 0.30 |
| ▸ | PLAU | P00749 | 1/20 | 0.30 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.30 |
| ▸ | POLB | P06746 | 1/20 | 0.30 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.30 |
| ▸ | MEN1 | O00255 | 1/20 | 0.30 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL7079025 | 0.78 | PDE2A (0.37) | PDE2AALDH1A1LMNAMAPTHTT | |
| SCHEMBL16139576 | 0.77 | PDE2A (0.36) | PDE2AALDH1A1TDP1CYP3A4HPGD | |
| SCHEMBL14934971 | 0.77 | ALDH1A1 (0.37) | PDE2AALDH1A1TDP1CYP3A4HPGD | |
| SCHEMBL16735777 | 0.73 | ALDH1A1 (0.33) | PDE2AALDH1A1TDP1CYP3A4HPGD | |
| SCHEMBL10711295 | 0.73 | ALDH1A1 (0.32) | ALDH1A1 | |
| SCHEMBL2085234 | 0.71 | RAPGEF4 (0.33) | PDE2AALDH1A1TDP1CYP3A4HPGD | |
| SCHEMBL24241149 | 0.68 | MAPK1 (0.42) | ALDH1A1LMNAMAPTKDM4ESMN1; SMN2 | |
| SCHEMBL10695243 | 0.68 | PDE2A (0.39) | PDE2AALDH1A1TDP1CYP3A4HPGD | |
| SCHEMBL10431590 | 0.66 | AR (0.33) | ALDH1A1KDM4E | |
| SCHEMBL2084576 | 0.65 | RAPGEF4 (0.32) | — |
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 |
|---|---|---|---|---|---|---|---|
| US-4546191-A | Trifluoromethyl-2-pyridinone or pyridinthione compounds and process for the preparation of the same | ISHIHARA SANGYO KAISHA LTD. (JP) | 1985-10-08 | — | — | US | disclosed |