Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HPGD | P15428 | 1/20 | 0.66 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.61 |
| ▸ | TSHR | P16473 | 1/20 | 0.61 |
| ▸ | POLB | P06746 | 1/20 | 0.61 |
| ▸ | TNKS | O95271 | 13/20 | 0.56 |
| ▸ | TNKS2 | Q9H2K2 | 13/20 | 0.56 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.53 |
| ▸ | PARP10 | Q53GL7 | 2/20 | 0.53 |
| ▸ | PARP2 | Q9UGN5 | 2/20 | 0.53 |
| ▸ | PARP1 | P09874 | 1/20 | 0.53 |
| ▸ | PARP4 | Q9UKK3 | 1/20 | 0.53 |
| ▸ | PARP3 | Q9Y6F1 | 1/20 | 0.53 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.49 |
| ▸ | DCTPP1 | Q9H773 | 1/20 | 0.48 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.48 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL21989243 | 0.82 | HPGD (0.59) | HPGDALDH1A1TSHRPOLBTNKS | |
| SCHEMBL20955312 | 0.80 | HPGD (0.68) | HPGDALDH1A1TSHRPOLBTNKS | |
| SCHEMBL12342910 | 0.80 | HPGD (1.00) | HPGDALDH1A1TSHRPOLBTNKS | |
| SCHEMBL15188523 | 0.79 | HPGD (0.66) | HPGDALDH1A1TSHRPOLBTNKS | |
| SCHEMBL1035103 | 0.77 | HPGD (0.77) | HPGDALDH1A1TSHRPOLBTNKS | |
| SCHEMBL1031367 | 0.76 | ALDH1A1 (1.00) | HPGDALDH1A1TSHRPOLBTNKS | |
| SCHEMBL1081986 | 0.76 | HPGD (0.75) | HPGDALDH1A1TSHRPOLBTNKS | |
| SCHEMBL22057404 | 0.75 | POLB (0.59) | HPGDALDH1A1TSHRPOLBTNKS | |
| SCHEMBL15173184 | 0.74 | POLB (0.72) | HPGDALDH1A1TSHRPOLBTNKS | |
| SCHEMBL15173439 | 0.73 | HPGD (0.69) | HPGDALDH1A1TSHRPOLBTNKS |
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-110023315-A | Novel compound or pharmacologically acceptable salt thereof | 国立研究开发法人理化学研究所 | 2019-07-16 | — | — | CN | disclosed |