Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GSK3B | P49841 | 1/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | ALOX5 | P09917 | 2/20 | 0.35 |
| ▸ | PKM | P14618 | 2/20 | 0.34 |
| ▸ | GAA | P10253 | 2/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | PPARG | P37231 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | NCOR2 | Q9Y618 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.32 |
| ▸ | ATM | Q13315 | 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 | |
|---|---|---|---|---|
| SCHEMBL9351950 | 0.83 | GSK3B (0.41) | GSK3BPOLBSMN1; SMN2HPGDALOX5 | |
| SCHEMBL27673491 | 0.82 | LMNA (0.42) | GSK3BPOLBSMN1; SMN2HPGDALOX5 | |
| SCHEMBL1158351 | 0.80 | ALOX5 (0.42) | GSK3BPOLBSMN1; SMN2HPGDALOX5 | |
| SCHEMBL10804734 | 0.78 | HPGD (0.41) | GSK3BPOLBSMN1; SMN2HPGDALOX5 | |
| SCHEMBL28750284 | 0.77 | ACHE (0.41) | GSK3BSMN1; SMN2HPGDALOX5PKM | |
| SCHEMBL11603252 | 0.76 | GSK3B (0.43) | GSK3BPOLBSMN1; SMN2HPGDALOX5 | |
| SCHEMBL647119 | 0.76 | ELANE (0.39) | GSK3BPOLBSMN1; SMN2HPGDALOX5 | |
| SCHEMBL10799153 | 0.73 | GSK3B (0.32) | GSK3B | |
| SCHEMBL14997477 | 0.72 | ALOX5 (0.35) | GSK3BSMN1; SMN2HPGDALOX5PKM | |
| SCHEMBL9026956 | 0.72 | GSK3B (0.35) | GSK3BPOLBSMN1; SMN2GAACYP1A2 |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-116143766-A | CDK2 degrading agent and application thereof | 四川海思科制药有限公司 | 2023-05-23 | — | — | CN | disclosed |
| CN-116063285-A | Substituted pyrimidine (thio) ester compound and application thereof | 沈阳中化农药化工研发有限公司 | 2023-05-05 | — | — | CN | disclosed |
| EP-1709043-B1 | PYRROLOPYRIDINE-SUBSTITUTED BENZOL DERIVATIVES FOR TREATING CARDIOVASCULAR DISEASES | BAYER HEALTHCARE AG (DE) | 2008-12-03 | — | — | EP | disclosed |
| EP-1709043-A1 | PYRROLOPYRIDINE-SUBSTITUTED BENZOL DERIVATIVES FOR TREATING CARDIOVASCULAR DISEASES | Bayer HealthCare AG (DE) | 2006-10-11 | — | — | EP | disclosed |
| WO-2005058891-A1 | PYRROLOPYRIDINE-SUBSTITUTED BENZOL DERIVATIVES FOR TREATING CARDIOVASCULAR DISEASES | BAYER HEALTHCARE AG (DE) | 2005-06-30 | — | — | WO | disclosed |
| EP-0401696-A2 | Process for production of sulfonium compounds and novel methylthiophenyl derivatives | MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) | 1990-12-12 | — | — | EP | disclosed |