Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GABRP | O00591 | 1/20 | 0.39 |
| ▸ | GABRD | O14764 | 1/20 | 0.39 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.39 |
| ▸ | GABRB1 | P18505 | 1/20 | 0.39 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.39 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.39 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.39 |
| ▸ | GABRA3 | P34903 | 1/20 | 0.39 |
| ▸ | GABRA2 | P47869 | 1/20 | 0.39 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.39 |
| ▸ | GABRA4 | P48169 | 1/20 | 0.39 |
| ▸ | GABRE | P78334 | 1/20 | 0.39 |
| ▸ | GABRA6 | Q16445 | 1/20 | 0.39 |
| ▸ | GABRG1 | Q8N1C3 | 1/20 | 0.39 |
| ▸ | GABRG3 | Q99928 | 1/20 | 0.39 |
| ▸ | GABRQ | Q9UN88 | 1/20 | 0.39 |
| ▸ | CDK4 | P11802 | 6/20 | 0.39 |
| ▸ | CCND1 | P24385 | 6/20 | 0.39 |
| ▸ | CCNE2 | O96020 | 2/20 | 0.39 |
| ▸ | CCNE1 | P24864 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL21427564 | 0.94 | CDK4 (0.38) | GABRPGABRDGABRA1GABRB1GABRG2 | |
| SCHEMBL21427504 | 0.87 | CDK4 (0.46) | GABRPGABRDGABRA1GABRB1GABRG2 | |
| SCHEMBL22155493 | 0.83 | CDK4 (0.51) | GABRPGABRDGABRA1GABRB1GABRG2 | |
| SCHEMBL31484350 | 0.83 | CDK4 (0.51) | GABRPGABRDGABRA1GABRB1GABRG2 | |
| SCHEMBL4554372 | 0.82 | GABRP (0.44) | GABRPGABRDGABRA1GABRB1GABRG2 | |
| SCHEMBL14951594 | 0.82 | CDK4 (0.48) | GABRPGABRDGABRA1GABRB1GABRG2 | |
| SCHEMBL22249827 | 0.79 | KDM4E (0.48) | GABRPGABRDGABRA1GABRB1GABRG2 | |
| SCHEMBL19573603 | 0.79 | CDK4 (0.40) | GABRPGABRDGABRA1GABRB1GABRG2 | |
| SCHEMBL29093453 | 0.77 | HSD17B10 (0.46) | ACHECYP1A2CYP1A1CYP1B1ALDH1A1 | |
| SCHEMBL4554410 | 0.77 | KDM4E (0.44) | GABRPGABRDGABRA1GABRB1GABRG2 |
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-2019190231-A1 | POLYCYCLIC COMPOUND AND ORGANIC LIGHT EMITTING DIODE COMPRISING SAME | 주식회사 엘지화학 | 2019-10-03 | — | — | WO | disclosed |