Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.35 |
| ▸ | RAD51 | Q06609 | 3/20 | 0.34 |
| ▸ | NPC1 | O15118 | 3/20 | 0.34 |
| ▸ | RAB9A | P51151 | 3/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.34 |
| ▸ | MAPT | P10636 | 2/20 | 0.34 |
| ▸ | MEN1 | O00255 | 2/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | HTT | P42858 | 1/20 | 0.34 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.33 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | PRKDC | P78527 | 1/20 | 0.33 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.32 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.32 |
| ▸ | PIK3CB | P42338 | 1/20 | 0.32 |
| ▸ | PIK3CG | P48736 | 1/20 | 0.32 |
| ▸ | APAF1 | O14727 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL8014932 | 0.83 | MAPT (0.40) | RAD51NPC1RAB9AALDH1A1MAPT | |
| SCHEMBL186752 | 0.79 | LMNA (0.51) | RAD51NPC1RAB9AALDH1A1MAPT | |
| SCHEMBL15731795 | 0.78 | PIK3R1 (0.39) | L3MBTL1RAD51NPC1RAB9AALDH1A1 | |
| SCHEMBL6330031 | 0.76 | KMT2A (0.49) | RAD51NPC1RAB9AALDH1A1MAPT | |
| SCHEMBL29483984 | 0.76 | RAD51 (0.51) | RAD51MAPTMEN1KMT2APRKDC | |
| SCHEMBL20050092 | 0.76 | ALDH1A1 (0.42) | L3MBTL1NPC1RAB9AALDH1A1MAPT | |
| SCHEMBL17576245 | 0.76 | AKR1C3 (0.44) | L3MBTL1NPC1RAB9AALDH1A1MAPT | |
| SCHEMBL1919863 | 0.76 | AKR1C3 (0.44) | RAD51NPC1RAB9AALDH1A1MAPT | |
| SCHEMBL20694863 | 0.75 | GSK3B (0.39) | RAD51 | |
| SCHEMBL18028120 | 0.75 | ALDH1A1 (0.42) | RAD51NPC1RAB9AALDH1A1MAPT |
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 |
|---|---|---|---|---|---|---|---|
| WO-2014044113-A1 | PYRAZOL[3,4-C] PYRIDINE DERIVATIVE, PREPARATION METHOD AND USE IN MEDICINE THEREOF | 上海恒瑞医药有限公司 (CN) | 2014-03-27 | — | — | WO | disclosed |
| WO-2014044107-A1 | PYRAZOL[3,4-C] PYRIDINE DERIVATIVE, PREPARATION METHOD AND USE IN MEDICINE THEREOF | 上海恒瑞医药有限公司 (CN) | 2014-03-27 | — | — | WO | disclosed |