Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DHFR | P00374 | 1/20 | 0.33 |
| ▸ | SIGMAR1 | Q99720 | 5/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.32 |
| ▸ | PGR | P06401 | 1/20 | 0.31 |
| ▸ | RORA | P35398 | 1/20 | 0.31 |
| ▸ | RORC | P51449 | 1/20 | 0.31 |
| ▸ | RORB | Q92753 | 1/20 | 0.31 |
| ▸ | CNR2 | P34972 | 2/20 | 0.31 |
| ▸ | EGFR | P00533 | 1/20 | 0.31 |
| ▸ | ERBB2 | P04626 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL9912918 | 0.93 | SIGMAR1 (0.34) | DHFRSIGMAR1CYP1A2CYP2A6PGR | |
| SCHEMBL9912898 | 0.93 | TP53 (0.35) | DHFRSIGMAR1CYP1A2CYP2A6PGR | |
| SCHEMBL9912948 | 0.92 | SIGMAR1 (0.36) | DHFRSIGMAR1CYP1A2CYP2A6 | |
| SCHEMBL9912942 | 0.91 | SIGMAR1 (0.35) | DHFRSIGMAR1 | |
| SCHEMBL9912978 | 0.89 | APP (0.36) | DHFRSIGMAR1CYP1A2CYP2A6CNR2 | |
| SCHEMBL15504022 | 0.87 | CYP1A2 (0.38) | DHFRSIGMAR1CYP1A2CYP2A6PGR | |
| SCHEMBL13725030 | 0.87 | AKR1C4 (0.36) | DHFRCNR2EGFRERBB2 | |
| SCHEMBL9912954 | 0.87 | TUBB4A (0.38) | CNR2EGFRERBB2 | |
| SCHEMBL9912910 | 0.85 | SIGMAR1 (0.37) | DHFRSIGMAR1CYP1A2CYP2A6PGR | |
| SCHEMBL9912917 | 0.85 | SIGMAR1 (0.37) | DHFRSIGMAR1CYP1A2CYP2A6 |
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 |
|---|---|---|---|---|---|---|---|
| US-8198801-B2 | Materials for injecting or transporting holes and organic electroluminescence devices using the same | LG CHEM, LTD. (KR) | 2012-06-12 | — | — | US | disclosed |
| US-8198801-B2 | Materials for injecting or transporting holes and organic electroluminescence devices using the same | LG CHEM, LTD. (KR) | 2012-06-12 | — | — | US | disclosed |