Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NAPRT | Q6XQN6 | 1/20 | 0.52 |
| ▸ | MEN1 | O00255 | 1/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.47 |
| ▸ | LTA4H | P09960 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.42 |
| ▸ | PLOD2 | O00469 | 2/20 | 0.42 |
| ▸ | PLOD3 | O60568 | 2/20 | 0.42 |
| ▸ | PLOD1 | Q02809 | 2/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.42 |
| ▸ | HPGD | P15428 | 1/20 | 0.42 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | MPO | P05164 | 1/20 | 0.41 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.41 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.41 |
| ▸ | HTT | P42858 | 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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL5428890 | 0.98 | NAPRT (0.50) | NAPRTMEN1KMT2ALTA4HALDH1A1 | |
| SCHEMBL2851869 | 0.82 | NAPRT (0.45) | NAPRTMEN1KMT2ALTA4HALDH1A1 | |
| SCHEMBL10767862 | 0.80 | TDP1 (0.52) | NAPRTMEN1KMT2AALDH1A1CYP3A4 | |
| SCHEMBL5141652 | 0.78 | TDP1 (0.50) | NAPRTMEN1KMT2AALDH1A1CYP3A4 | |
| SCHEMBL27566013 | 0.77 | ALDH1A1 (0.58) | MEN1KMT2AALDH1A1CYP1A2CYP3A4 | |
| SCHEMBL3844697 | 0.75 | NAPRT (0.52) | NAPRTMEN1KMT2AALDH1A1CYP1A2 | |
| SCHEMBL28624819 | 0.75 | NAPRT (0.52) | NAPRTMEN1KMT2ALTA4HALDH1A1 | |
| SCHEMBL1380026 | 0.74 | KMT2A (0.45) | MEN1KMT2AALDH1A1CYP1A2CYP3A4 | |
| SCHEMBL6007960 | 0.73 | NAPRT (0.50) | NAPRTMEN1KMT2ALTA4HALDH1A1 | |
| SCHEMBL6007952 | 0.73 | NAPRT (0.50) | NAPRTMEN1KMT2ALTA4HALDH1A1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1674456-B1 | Use of 2-fluoro- 3-ketoesters for preparing 3-fluoro-6,7,8,9-tetrahydro-4-H-pyrimdo[1,2-a]pyrimidin-4-ones | SANOFI AVENTIS (FR) | 2008-07-16 | — | — | EP | claimed |
| EP-1603876-B1 | PROCESS FOR THE PREPARATION OF PYRIDINYL AND PYRIMIDINYL MONO-FLUORINATED BETA KETO ESTERS | SANOFI AVENTIS (FR) | 2007-02-14 | — | — | EP | claimed |