Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HPGD | P15428 | 10/20 | 0.60 |
| ▸ | TP53 | P04637 | 1/20 | 0.51 |
| ▸ | GLA | P06280 | 1/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.51 |
| ▸ | GAA | P10253 | 2/20 | 0.51 |
| ▸ | PKM | P14618 | 1/20 | 0.51 |
| ▸ | HTT | P42858 | 1/20 | 0.51 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.50 |
| ▸ | RCE1 | Q9Y256 | 1/20 | 0.50 |
| ▸ | TAS1R3 | Q7RTX0 | 1/20 | 0.49 |
| ▸ | TAS1R1 | Q7RTX1 | 1/20 | 0.49 |
| ▸ | NLRP3 | Q96P20 | 1/20 | 0.48 |
| ▸ | NPC1 | O15118 | 1/20 | 0.47 |
| ▸ | POLB | P06746 | 1/20 | 0.47 |
| ▸ | PLA2G1B | P04054 | 1/20 | 0.47 |
| ▸ | ATG4B | Q9Y4P1 | 1/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.46 |
| ▸ | MEN1 | O00255 | 1/20 | 0.45 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.45 |
| ▸ | CTSD | P07339 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL18641941 | 1.00 | HPGD (0.60) | HPGDTP53GLAALDH1A1GAA | |
| SCHEMBL18641948 | 0.92 | HPGD (0.55) | HPGDTP53GLAALDH1A1GAA | |
| SCHEMBL29617693 | 0.92 | HPGD (0.55) | HPGDTP53GLAALDH1A1GAA | |
| SCHEMBL20583708 | 0.89 | HPGD (0.54) | HPGDTP53GLAALDH1A1GAA | |
| SCHEMBL21817011 | 0.85 | HPGD (0.64) | HPGDTP53GLAALDH1A1HTT | |
| SCHEMBL23304098 | 0.84 | CSF1R (0.42) | HPGDALDH1A1TAS1R3TAS1R1NPC1 | |
| SCHEMBL18641768 | 0.82 | HPGD (0.50) | HPGDTP53GLAALDH1A1GAA | |
| SCHEMBL16650820 | 0.81 | HPGD (0.58) | HPGDTP53GLAALDH1A1HTT | |
| SCHEMBL18989291 | 0.81 | PDE10A (0.47) | HPGDPLA2G1BATG4BKMT2A | |
| SCHEMBL20583687 | 0.79 | PDE10A (0.51) | HPGDALDH1A1NPC1KMT2AP2RX7 |
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-114685516-A | Pyrazolopyrimidine derivatives as BTK inhibitors for the treatment of cancer | 洛克索肿瘤学股份有限公司 | 2022-07-01 | — | — | CN | disclosed |
| CN-108431007-B | Pyrazolopyrimidine derivatives as BTK inhibitors for the treatment of cancer | 洛克索肿瘤学股份有限公司 | 2022-06-07 | — | — | CN | disclosed |