Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.47 |
| ▸ | NPC1 | O15118 | 3/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.45 |
| ▸ | CASR | P41180 | 1/20 | 0.44 |
| ▸ | PAX8 | Q06710 | 1/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.44 |
| ▸ | RAB9A | P51151 | 3/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.44 |
| ▸ | HPGD | P15428 | 1/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.44 |
| ▸ | TP53BP1 | Q12888 | 1/20 | 0.44 |
| ▸ | USP2 | O75604 | 2/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.43 |
| ▸ | HTR2A | P28223 | 2/20 | 0.43 |
| ▸ | HTR2C | P28335 | 2/20 | 0.43 |
| ▸ | HRH1 | P35367 | 2/20 | 0.43 |
| ▸ | DRD3 | P35462 | 2/20 | 0.43 |
| ▸ | HTR2B | P41595 | 2/20 | 0.43 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL29016063 | 0.90 | TDP1 (0.46) | TDP1NPC1KMT2ACASRPAX8 | |
| SCHEMBL8349531 | 0.83 | TDP1 (0.68) | TDP1NPC1KMT2ACYP1A2RAB9A | |
| SCHEMBL29016000 | 0.82 | RAB9A (0.50) | TDP1NPC1KMT2ACYP1A2RAB9A | |
| SCHEMBL19762350 | 0.80 | CYP1A2 (0.55) | TDP1NPC1CYP1A2RAB9ACYP2C9 | |
| SCHEMBL29016002 | 0.80 | CYP4F2 (0.50) | TDP1NPC1KMT2ACYP1A2RAB9A | |
| SCHEMBL29015985 | 0.79 | CYP4F2 (0.52) | NPC1KMT2ACYP1A2RAB9ACYP2C9 | |
| SCHEMBL28558279 | 0.78 | SCN5A (0.47) | TDP1NPC1KMT2ACYP1A2RAB9A | |
| SCHEMBL23786271 | 0.77 | ALDH1A1 (0.56) | TDP1KMT2ACYP1A2SMN1; SMN2HPGD | |
| SCHEMBL30285481 | 0.77 | TDP1 (0.58) | TDP1NPC1CYP1A2RAB9ASMN1; SMN2 | |
| SCHEMBL135137 | 0.76 | CASR (0.54) | NPC1KMT2ACASRCYP1A2RAB9A |
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-112759531-B | Novel imine compound and preparation method thereof | 中国石油化工股份有限公司 | 2023-07-21 | — | — | CN | disclosed |
| CN-112759675-B | Catalyst component for preparing polyolefin, catalyst and application thereof | 中国石油化工股份有限公司 | 2023-05-02 | — | — | CN | disclosed |