Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CXCR4 | P61073 | 1/20 | 0.56 |
| ▸ | RECQL | P46063 | 1/20 | 0.46 |
| ▸ | KDM5C | P41229 | 1/20 | 0.46 |
| ▸ | KDM4C | Q9H3R0 | 1/20 | 0.46 |
| ▸ | HRH3 | Q9Y5N1 | 4/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.41 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.41 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.41 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 2/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.39 |
| ▸ | NPC1 | O15118 | 2/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.39 |
| ▸ | METAP2 | P50579 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL20356775 | 0.83 | CXCR4 (0.56) | CXCR4KDM5CKDM4CHRH3CHRNB2 | |
| Hydrochloric Acid SCHEMBL28331933 | 0.81 | CXCR4 (0.55) | CXCR4KDM5CKDM4CHRH3CYP2C19 | |
| SCHEMBL17144820 | 0.79 | CXCR4 (0.41) | CXCR4RECQLKDM5CKDM4CLMNA | |
| SCHEMBL1722737 | 0.77 | CXCR4 (0.50) | CXCR4KDM5CKDM4CHRH3CYP2C19 | |
| SCHEMBL14896745 | 0.77 | CXCR4 (0.50) | CXCR4KDM5CKDM4CHRH3CYP2C19 | |
| SCHEMBL940224 | 0.77 | CXCR4 (0.50) | CXCR4KDM5CKDM4CHRH3NPC1 | |
| SCHEMBL3257025 | 0.77 | CXCR4 (0.50) | CXCR4KDM5CKDM4CHRH3NPC1 | |
| SCHEMBL6057472 | 0.76 | CXCR4 (0.57) | CXCR4HRH3HIF1ACHRNB2CHRNA4 | |
| SCHEMBL25427279 | 0.76 | CXCR4 (0.49) | CXCR4KDM5CKDM4CHRH3CYP2C19 | |
| SCHEMBL17538302 | 0.76 | HRH3 (0.50) | HRH3CHRNB2CHRNA4L3MBTL1HRH4 |
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-110372703-A | Five-ring heterocycles miazines compound and application thereof | 罗欣生物科技（上海）有限公司 | 2019-10-25 | — | — | CN | disclosed |
| WO-2019196918-A1 | FIVE-MEMBERED HETEROCYCLO-PYRIMIDINE COMPOUND, PHARMACEUTICAL COMPOSITION AND USE THEREOF | 罗欣药业(上海)有限公司 | 2019-10-17 | — | — | WO | disclosed |