Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 4/20 | 0.40 |
| ▸ | PTGER4 | P35408 | 2/20 | 0.39 |
| ▸ | HPGD | P15428 | 5/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.37 |
| ▸ | HCAR3 | P49019 | 1/20 | 0.36 |
| ▸ | TDO2 | P48775 | 1/20 | 0.36 |
| ▸ | BACE1 | P56817 | 1/20 | 0.36 |
| ▸ | BACE2 | Q9Y5Z0 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 2/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | CNR2 | P34972 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL25279173 | 1.00 | KMT2A (0.40) | KMT2APTGER4HPGDALDH1A1KDM4E | |
| SCHEMBL31463429 | 1.00 | KMT2A (0.40) | KMT2APTGER4HPGDALDH1A1KDM4E | |
| SCHEMBL30393343 | 0.90 | KMT2A (0.43) | KMT2AHPGDALDH1A1KDM4EHCAR3 | |
| SCHEMBL28754429 | 0.90 | PTGER4 (0.47) | KMT2APTGER4HPGDALDH1A1KDM4E | |
| SCHEMBL29640515 | 0.90 | PTGER4 (0.47) | KMT2APTGER4HPGDALDH1A1KDM4E | |
| SCHEMBL23286839 | 0.90 | PTGER4 (0.47) | KMT2APTGER4HPGDALDH1A1KDM4E | |
| SCHEMBL24901946 | 0.88 | PTGER4 (0.43) | KMT2APTGER4HPGDALDH1A1KDM4E | |
| SCHEMBL30232663 | 0.88 | PTGER4 (0.43) | KMT2APTGER4HPGDALDH1A1KDM4E | |
| SCHEMBL28754443 | 0.86 | HCAR3 (0.46) | KMT2AHPGDALDH1A1KDM4EHCAR3 | |
| SCHEMBL28754455 | 0.86 | HCAR3 (0.46) | KMT2AHPGDALDH1A1KDM4EHCAR3 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2023222124-A1 | 5,6-DIHYDRO-1,2,4-TRIAZINE COMPOUND AND PHARMACEUTICAL USE THEREOF AS GLP-1 RECEPTOR AGONIST | 中国科学院上海药物研究所 | 2023-11-23 | — | — | WO | disclosed |
| WO-2023169436-A1 | BENZO BICYCLIC COMPOUND, AND PREPARATION METHOD AND APPLICATION THEREOF | 广州市联瑞制药有限公司 | 2023-09-14 | — | — | WO | disclosed |