Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NAPRT | Q6XQN6 | 2/20 | 0.53 |
| ▸ | KDM4C | Q9H3R0 | 1/20 | 0.43 |
| ▸ | SRD5A2 | P31213 | 3/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | PLOD2 | O00469 | 2/20 | 0.38 |
| ▸ | PLOD3 | O60568 | 2/20 | 0.38 |
| ▸ | PLOD1 | Q02809 | 2/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | APP | P05067 | 1/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| Pyridine SCHEMBL28135463 | 0.81 | TSHR (0.36) | NAPRTALDH1A1CYP1A2CYP2C9HPGD | |
| Isonicotinic Acid SCHEMBL28081623 | 0.76 | NAPRT (0.59) | NAPRTKDM4CMEN1KMT2AMAPT | |
| SCHEMBL827830 | 0.75 | — | — | |
| Isonicotinic Acid SCHEMBL2197 | 0.75 | NAPRT (0.94) | NAPRTKDM4CSRD5A2MEN1KMT2A | |
| Isonicotinic Acid SCHEMBL1025948 | 0.75 | NAPRT (0.94) | NAPRTKDM4CSRD5A2MEN1KMT2A | |
| Isonicotinic Acid SCHEMBL28101509 | 0.74 | NAPRT (0.74) | NAPRTSRD5A2MEN1KMT2APLOD2 | |
| SCHEMBL28875100 | 0.73 | MAOB (0.33) | ALDH1A1KDM4EDAOTSHRMAPK1 | |
| Isonicotinic Acid SCHEMBL1414914 | 0.73 | NAPRT (1.00) | NAPRTKDM4CSRD5A2MEN1KMT2A | |
| Isonicotinic Acid SCHEMBL1108 | 0.73 | — | — | |
| Isonicotinic Acid SCHEMBL28136907 | 0.72 | NAPRT (0.71) | NAPRTMEN1KMT2APLOD2PLOD3 |
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 |
|---|---|---|---|---|---|---|---|
| CN-106255688-A | Morpholine pyridine derivate | 豪夫迈·罗氏有限公司 | 2016-12-21 | — | — | CN | disclosed |