Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 7/20 | 0.68 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.68 |
| ▸ | TSHR | P16473 | 2/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.46 |
| ▸ | NOTUM | Q6P988 | 3/20 | 0.44 |
| ▸ | SLC6A7 | Q99884 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 2/20 | 0.42 |
| ▸ | MAPT | P10636 | 2/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.42 |
| ▸ | HPGD | P15428 | 1/20 | 0.42 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | MDM2 | Q00987 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL15416556 | 0.85 | KDM4E (0.81) | KDM4ECYP2C19TSHRALDH1A1NOTUM | |
| SCHEMBL195842 | 0.81 | KDM4E (1.00) | KDM4ECYP2C19ALDH1A1NOTUMLMNA | |
| SCHEMBL16302107 | 0.79 | KDM4E (0.45) | KDM4ECYP2C19ALDH1A1NOTUMHSD17B10 | |
| SCHEMBL17234262 | 0.78 | GRIN2B (0.54) | KDM4ECYP2C19TSHRALDH1A1NOTUM | |
| SCHEMBL3585722 | 0.78 | KDM4E (0.50) | KDM4ECYP2C19TSHRALDH1A1LMNA | |
| SCHEMBL21061696 | 0.78 | KDM4E (0.47) | KDM4ECYP2C19TSHRALDH1A1LMNA | |
| SCHEMBL21151895 | 0.77 | KDM4E (0.42) | KDM4ECYP2C19ALDH1A1NOTUMHSD17B10 | |
| SCHEMBL29364193 | 0.76 | SLC6A7 (0.50) | KDM4ECYP2C19SLC6A7 | |
| SCHEMBL3575820 | 0.76 | SLC6A7 (0.58) | KDM4ETSHRALDH1A1SLC6A7MAPK1 | |
| SCHEMBL16433993 | 0.75 | NOTUM (0.49) | KDM4ECYP2C19NOTUMLMNA |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-116322692-A | Autotaxin inhibitor compounds | 日东制药株式会社 | 2023-06-23 | — | — | CN | disclosed |
| CN-111479813-B | Triazolobenzazepines as vasopressin V1A receptor antagonists | 吉瑞工厂 | 2023-03-21 | — | — | CN | disclosed |
| CN-111479813-A | Triazolobenzazepines as vasopressin V1A receptor antagonists | 吉瑞工厂 | 2020-07-31 | — | — | CN | disclosed |