Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.41 |
| ▸ | GPR3 | P46089 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 4/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.39 |
| ▸ | TSHR | P16473 | 2/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.39 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 2/20 | 0.37 |
| ▸ | MAOA | P21397 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 2/20 | 0.35 |
| ▸ | RAB9A | P51151 | 2/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | HTR1A | P08908 | 2/20 | 0.35 |
| ▸ | DRD2 | P14416 | 2/20 | 0.35 |
| ▸ | PDGFRB | P09619 | 1/20 | 0.34 |
| ▸ | PDGFRA | P16234 | 1/20 | 0.34 |
| ▸ | MET | P08581 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL29845939 | 1.00 | KDM4E (0.41) | KDM4EGPR3ALDH1A1CYP1A2CYP3A4 | |
| SCHEMBL29521539 | 0.87 | CYP1A2 (0.52) | KDM4EGPR3ALDH1A1CYP1A2CYP3A4 | |
| SCHEMBL29580557 | 0.87 | CYP1A2 (0.52) | KDM4EGPR3ALDH1A1CYP1A2CYP3A4 | |
| SCHEMBL29364237 | 0.87 | ALDH1A1 (0.52) | KDM4EALDH1A1CYP1A2CYP3A4TSHR | |
| SCHEMBL443832 | 0.87 | ALDH1A1 (0.52) | KDM4EALDH1A1CYP1A2CYP3A4TSHR | |
| Pyrene SCHEMBL25333032 | 0.87 | ALDH1A1 (0.52) | KDM4EALDH1A1CYP1A2CYP3A4TSHR | |
| SCHEMBL29393751 | 0.87 | ALDH1A1 (0.52) | KDM4EALDH1A1CYP1A2CYP3A4TSHR | |
| SCHEMBL5466768 | 0.87 | CYP1A2 (0.52) | KDM4EGPR3ALDH1A1CYP1A2CYP3A4 | |
| SCHEMBL30509737 | 0.85 | ALDH1A1 (0.50) | KDM4EALDH1A1CYP1A2CYP3A4TSHR | |
| SCHEMBL30615978 | 0.85 | ALDH1A1 (0.50) | KDM4EALDH1A1CYP1A2CYP3A4TSHR |
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-103319694-B | Conjugated polymer containing pyrido phenanthridines-5-ketone and preparation method thereof and application | 华南理工大学 | 2016-06-29 | — | — | CN | disclosed |
| CN-103319695-B | Conjugated polymer containing 4,9-diaza pyrene and preparation method thereof and application | 华南理工大学 | 2016-06-22 | — | — | CN | disclosed |