Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 2/20 | 0.42 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.41 |
| ▸ | MAPT | P10636 | 6/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | HTT | P42858 | 4/20 | 0.41 |
| ▸ | HPGD | P15428 | 4/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.40 |
| ▸ | PKM | P14618 | 1/20 | 0.40 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 6/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 6/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL17485913 | 0.95 | CYP1A2 (0.42) | CYP1A2CYP2A6KDM4EMAPTLMNA | |
| SCHEMBL9912955 | 0.92 | CYP1A2 (0.41) | CYP1A2CYP2A6KDM4EMAPTLMNA | |
| SCHEMBL9912897 | 0.91 | MTNR1A (0.43) | CYP1A2CYP2A6KDM4EMAPTHTT | |
| SCHEMBL9912929 | 0.91 | CYP1A2 (0.40) | CYP1A2CYP2A6KDM4EMAPTLMNA | |
| SCHEMBL9912909 | 0.91 | KDM4E (0.47) | CYP1A2KDM4EMAPTLMNAHTT | |
| SCHEMBL4843245 | 0.91 | KDM4E (0.47) | CYP1A2KDM4EMAPTLMNAHTT | |
| SCHEMBL9912937 | 0.90 | MAPT (0.46) | KDM4EMAPTLMNAHTTHPGD | |
| SCHEMBL17485891 | 0.90 | MAPT (0.46) | KDM4EMAPTLMNAHTTHPGD | |
| SCHEMBL17414859 | 0.90 | MAPT (0.46) | KDM4EMAPTLMNAHTTHPGD | |
| SCHEMBL9912871 | 0.90 | L3MBTL1 (0.36) | CYP1A2CYP2A6KDM4EMAPTHTT |
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 |