Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDK4 | P11802 | 2/20 | 0.48 |
| ▸ | CCND1 | P24385 | 2/20 | 0.48 |
| ▸ | GABRP | O00591 | 2/20 | 0.42 |
| ▸ | GABRD | O14764 | 2/20 | 0.42 |
| ▸ | GABRA1 | P14867 | 2/20 | 0.42 |
| ▸ | GABRB1 | P18505 | 2/20 | 0.42 |
| ▸ | GABRG2 | P18507 | 2/20 | 0.42 |
| ▸ | GABRB3 | P28472 | 2/20 | 0.42 |
| ▸ | GABRA5 | P31644 | 2/20 | 0.42 |
| ▸ | GABRA3 | P34903 | 2/20 | 0.42 |
| ▸ | GABRA2 | P47869 | 2/20 | 0.42 |
| ▸ | GABRB2 | P47870 | 2/20 | 0.42 |
| ▸ | GABRA4 | P48169 | 2/20 | 0.42 |
| ▸ | GABRE | P78334 | 2/20 | 0.42 |
| ▸ | GABRA6 | Q16445 | 2/20 | 0.42 |
| ▸ | GABRG1 | Q8N1C3 | 2/20 | 0.42 |
| ▸ | GABRG3 | Q99928 | 2/20 | 0.42 |
| ▸ | GABRQ | Q9UN88 | 2/20 | 0.42 |
| ▸ | AHR | P35869 | 2/20 | 0.42 |
| ▸ | IMPDH2 | P12268 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL20068547 | 0.83 | CDK4 (0.50) | CDK4CCND1GABRPGABRDGABRA1 | |
| SCHEMBL23866390 | 0.82 | ALDH1A1 (0.45) | CDK4CCND1GABRPGABRDGABRA1 | |
| SCHEMBL20068441 | 0.82 | CDK4 (0.49) | CDK4CCND1GABRPGABRDGABRA1 | |
| SCHEMBL17033384 | 0.81 | CDK4 (0.46) | CDK4CCND1GABRPGABRDGABRA1 | |
| SCHEMBL17033387 | 0.79 | KIF11 (0.51) | GABRPGABRDGABRA1GABRB1GABRG2 | |
| SCHEMBL23723203 | 0.79 | GABRA1 (0.50) | CDK4CCND1GABRPGABRDGABRA1 | |
| SCHEMBL20070688 | 0.77 | GABRA1 (0.42) | CDK4CCND1GABRPGABRDGABRA1 | |
| SCHEMBL19890589 | 0.77 | GABRA1 (0.47) | CDK4CCND1GABRPGABRDGABRA1 | |
| SCHEMBL22172046 | 0.76 | GABRA1 (0.44) | CDK4CCND1GABRPGABRDGABRA1 | |
| SCHEMBL22172006 | 0.76 | AHR (0.44) | CDK4CCND1GABRPGABRDGABRA1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2015125986-A1 | ORGANIC COMPOUND AND ORGANIC ELECTROLUMINESCENT DEVICE COMPRISING SAME | 주식회사 두산 | 2015-08-27 | — | — | WO | disclosed |