Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDK4 | P11802 | 1/20 | 0.37 |
| ▸ | CCND1 | P24385 | 1/20 | 0.37 |
| ▸ | AHR | P35869 | 5/20 | 0.37 |
| ▸ | CYP1A1 | P04798 | 6/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 6/20 | 0.36 |
| ▸ | CYP1B1 | Q16678 | 6/20 | 0.36 |
| ▸ | PIM1 | P11309 | 1/20 | 0.36 |
| ▸ | CSNK2A2 | P19784 | 1/20 | 0.36 |
| ▸ | CSNK2B | P67870 | 1/20 | 0.36 |
| ▸ | PIM3 | Q86V86 | 1/20 | 0.36 |
| ▸ | PIM2 | Q9P1W9 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 2/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | CASP1 | P29466 | 1/20 | 0.34 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.34 |
| ▸ | GABRP | O00591 | 1/20 | 0.34 |
| ▸ | GABRD | O14764 | 1/20 | 0.34 |
| ▸ | GABRA1 | P14867 | 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 | |
|---|---|---|---|---|
| SCHEMBL21427735 | 0.93 | GABRP (0.39) | CDK4CCND1AHRCYP1A1CYP1A2 | |
| SCHEMBL21427506 | 0.87 | CDK4 (0.46) | CDK4CCND1AHRCYP1A1CYP1A2 | |
| SCHEMBL4554322 | 0.82 | AHR (0.53) | CDK4CCND1AHRPIM1CSNK2A2 | |
| SCHEMBL14951574 | 0.82 | CDK4 (0.48) | CDK4CCND1AHRCYP1A1CYP1A2 | |
| SCHEMBL30512157 | 0.81 | CDK4 (0.53) | CDK4CCND1MEN1KMT2AKDM4E | |
| SCHEMBL22155551 | 0.81 | CDK4 (0.53) | CDK4CCND1MEN1KMT2AKDM4E | |
| SCHEMBL19573593 | 0.79 | L3MBTL1 (0.41) | CDK4CCND1AHRCYP1A1CYP1A2 | |
| SCHEMBL23031075 | 0.77 | L3MBTL1 (0.41) | CDK4CCND1AHRCYP1A1CYP1A2 | |
| SCHEMBL16783381 | 0.77 | L3MBTL1 (0.47) | AHRCYP1A1CYP1A2MEN1KMT2A | |
| SCHEMBL21427564 | 0.77 | CDK4 (0.38) | CDK4CCND1CYP1A1CYP1A2CYP1B1 |
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 |