Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PLOD2 | O00469 | 2/20 | 0.57 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.51 |
| ▸ | APP | P05067 | 1/20 | 0.51 |
| ▸ | GAA | P10253 | 1/20 | 0.51 |
| ▸ | HCAR3 | P49019 | 1/20 | 0.51 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.51 |
| ▸ | PLOD3 | O60568 | 1/20 | 0.48 |
| ▸ | PLOD1 | Q02809 | 1/20 | 0.48 |
| ▸ | F7 | P08709 | 1/20 | 0.46 |
| ▸ | F3 | P13726 | 1/20 | 0.46 |
| ▸ | SARM1 | Q6SZW1 | 1/20 | 0.46 |
| ▸ | SIRT2 | Q8IXJ6 | 1/20 | 0.46 |
| ▸ | SIRT6 | Q8N6T7 | 1/20 | 0.46 |
| ▸ | SIRT1 | Q96EB6 | 1/20 | 0.46 |
| ▸ | SIRT3 | Q9NTG7 | 1/20 | 0.46 |
| ▸ | SIRT5 | Q9NXA8 | 1/20 | 0.46 |
| ▸ | SIRT4 | Q9Y6E7 | 1/20 | 0.46 |
| ▸ | LMNA | P02545 | 1/20 | 0.46 |
| ▸ | TBXAS1 | P24557 | 4/20 | 0.45 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL14073817 | 0.83 | PLOD2 (0.59) | PLOD2ALDH1A1APPGAAHCAR3 | |
| SCHEMBL27512365 | 0.83 | PLOD2 (0.58) | PLOD2ALDH1A1APPGAAHCAR3 | |
| SCHEMBL20561378 | 0.81 | PLOD2 (0.50) | PLOD2ALDH1A1APPGAAHCAR3 | |
| SCHEMBL16282942 | 0.81 | TSHR (0.59) | PLOD2ALDH1A1APPGAAHCAR3 | |
| SCHEMBL28053583 | 0.81 | PLOD2 (0.56) | PLOD2ALDH1A1APPGAAHCAR3 | |
| SCHEMBL16281904 | 0.79 | KMT2A (0.64) | PLOD2ALDH1A1APPGAAHCAR3 | |
| SCHEMBL16282941 | 0.79 | KMT2A (0.64) | PLOD2ALDH1A1APPGAAHCAR3 | |
| SCHEMBL6199618 | 0.78 | PLOD2 (0.53) | PLOD2ALDH1A1APPGAAHCAR3 | |
| SCHEMBL27873270 | 0.77 | PLOD2 (0.51) | PLOD2ALDH1A1APPGAAHCAR3 | |
| SCHEMBL2694778 | 0.76 | PLOD2 (0.79) | PLOD2ALDH1A1APPGAAHCAR3 |
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 |
|---|---|---|---|---|---|---|---|
| CN-101213189-B | 4-(pyridin-3-yl)-2-(pyridin-2-yl)-1,2-dihydro-3h-pyrazol-3-one derivatives as specific hif-prolyl-4-hydroxylase inhibitors for treating cardiovascular and haematological diseases | BAYER HEALTHCARE AG | 2011-06-22 | — | — | CN | disclosed |
| CN-101213189-A | 4-(pyridin-3-yl)-2-(pyridin-2-yl)-1,2-dihydro-3h-pyrazol-3-one derivatives as specific hif-prolyl-4-hydroxylase inhibitors for treating cardiovascular and haematological diseases | BAYER HEALTHCARE AG (DE) | 2008-07-02 | — | — | CN | disclosed |