Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | VCAM1 | P19320 | 8/20 | 0.36 |
| ▸ | HCAR3 | P49019 | 1/20 | 0.34 |
| ▸ | CYP19A1 | P11511 | 4/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.33 |
| ▸ | PIN1 | Q13526 | 1/20 | 0.32 |
| ▸ | GLP1R | P43220 | 1/20 | 0.32 |
| ▸ | POLB | P06746 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 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 | |
|---|---|---|---|---|
| SCHEMBL29029068 | 0.80 | ALDH1A1 (0.64) | ALDH1A1KDM4EVCAM1HCAR3NPSR1 | |
| SCHEMBL29029075 | 0.79 | VCAM1 (0.37) | ALDH1A1KDM4EVCAM1CYP19A1PIN1 | |
| SCHEMBL31208231 | 0.79 | ALDH1A1 (0.43) | ALDH1A1KDM4EVCAM1HCAR3CYP19A1 | |
| SCHEMBL29029087 | 0.78 | S1PR4 (0.39) | ALDH1A1VCAM1CYP19A1PIN1POLB | |
| SCHEMBL31425811 | 0.74 | HCAR3 (0.44) | ALDH1A1KDM4EVCAM1HCAR3PIN1 | |
| SCHEMBL31006636 | 0.73 | KDM4E (0.32) | ALDH1A1KDM4E | |
| SCHEMBL15994474 | 0.68 | ALDH1A1 (0.40) | ALDH1A1VCAM1NPSR1POLBMAPT | |
| SCHEMBL30917043 | 0.67 | MMP1 (0.44) | ALDH1A1KDM4EPOLBMAPTSMN1; SMN2 | |
| SCHEMBL2178150 | 0.67 | HCAR3 (0.37) | ALDH1A1KDM4EVCAM1HCAR3PIN1 | |
| SCHEMBL31613170 | 0.65 | CHRNB2 (0.46) | ALDH1A1KDM4EVCAM1NPSR1MAPT |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-116368128-A | Heterocyclic compounds as CBP/EP300 bromodomain inhibitors | 奥瑞基尼肿瘤有限公司 | 2023-06-30 | — | — | CN | disclosed |