Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP1 | P09874 | 2/20 | 0.36 |
| ▸ | PARP2 | Q9UGN5 | 1/20 | 0.36 |
| ▸ | RECQL | P46063 | 1/20 | 0.35 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.33 |
| ▸ | IKBKB | O14920 | 1/20 | 0.33 |
| ▸ | CHUK | O15111 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 2/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.32 |
| ▸ | HTR2B | P41595 | 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 | |
|---|---|---|---|---|
| SCHEMBL28624518 | 0.84 | HTR7 (0.46) | ALDH1A1NPC1RAB9AMEN1KMT2A | |
| SCHEMBL28466149 | 0.80 | HPGD (0.40) | PARP1RECQLALDH1A1RAB9AHPGD | |
| SCHEMBL28615279 | 0.77 | HSP90AB1 (0.41) | PARP1ALDH1A1MEN1KMT2ANR1I2 | |
| SCHEMBL28620034 | 0.74 | G6PD (0.45) | PARP1PARP2RECQLMEN1KMT2A | |
| SCHEMBL14124997 | 0.74 | PARP1 (0.45) | PARP1PARP2ALDH1A1MEN1KMT2A | |
| SCHEMBL3907572 | 0.72 | ACKR3 (0.49) | SLC6A4ALDH1A1NPC1RAB9AHPGD | |
| SCHEMBL3026191 | 0.70 | DGAT1 (0.47) | PARP1ALDH1A1MEN1KMT2AHPGD | |
| SCHEMBL6118090 | 0.66 | LMNA (0.44) | ALDH1A1RAB9AMEN1KMT2AHPGD | |
| SCHEMBL811064 | 0.66 | DGAT1 (0.52) | PARP1RECQLALDH1A1MEN1KMT2A | |
| SCHEMBL30997900 | 0.65 | HDAC8 (0.64) | ALDH1A1NPC1MEN1KMT2AHPGD |
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-106687458-B | Substituted oxopyridine derivatives | 拜耳制药股份公司 | 2020-10-27 | — | — | CN | disclosed |