Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDK4 | P11802 | 4/20 | 0.77 |
| ▸ | CCND1 | P24385 | 4/20 | 0.77 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.51 |
| ▸ | SMPD1 | P17405 | 1/20 | 0.51 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.50 |
| ▸ | HTR2A | P28223 | 1/20 | 0.50 |
| ▸ | HTR2C | P28335 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL5667825 | 0.93 | CDK4 (0.72) | CDK4CCND1P2RX7SMPD1HSD17B10 | |
| SCHEMBL3195575 | 0.86 | CDK4 (0.70) | CDK4CCND1SMPD1HSD17B10HTR2A | |
| SCHEMBL29382442 | 0.86 | CDK4 (0.70) | CDK4CCND1SMPD1HSD17B10HTR2A | |
| SCHEMBL19748097 | 0.79 | CDK4 (0.82) | CDK4CCND1P2RX7HTR2AHTR2C | |
| SCHEMBL9702210 | 0.79 | CDK4 (0.82) | CDK4CCND1P2RX7HTR2AHTR2C | |
| SCHEMBL24398975 | 0.79 | CDK4 (0.82) | CDK4CCND1P2RX7HTR2AHTR2C | |
| SCHEMBL4976386 | 0.79 | CDK4 (0.82) | CDK4CCND1P2RX7HTR2AHTR2C | |
| SCHEMBL6396944 | 0.79 | CDK4 (0.82) | CDK4CCND1P2RX7HTR2AHTR2C | |
| SCHEMBL5989829 | 0.79 | CDK4 (0.82) | CDK4CCND1P2RX7HTR2AHTR2C | |
| SCHEMBL30376 | 0.79 | CDK4 (0.82) | CDK4CCND1P2RX7HTR2AHTR2C |
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-107635961-A | Indoles analog and its application method as 5 oxo ETE receptor antagonists | 皇家学习促进学会/麦吉尔大学 | 2018-01-26 | — | — | CN | disclosed |