Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2A6 | P11509 | 2/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 6/20 | 0.48 |
| ▸ | LMNA | P02545 | 4/20 | 0.48 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.48 |
| ▸ | METAP1 | P53582 | 2/20 | 0.48 |
| ▸ | CCR1 | P32246 | 2/20 | 0.48 |
| ▸ | CCR5 | P51681 | 2/20 | 0.48 |
| ▸ | CCR8 | P51685 | 2/20 | 0.48 |
| ▸ | POLB | P06746 | 1/20 | 0.48 |
| ▸ | BLM | P54132 | 1/20 | 0.48 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.48 |
| ▸ | DOHH | Q9BU89 | 1/20 | 0.48 |
| ▸ | P4HTM | Q9NXG6 | 1/20 | 0.48 |
| ▸ | CA12 | O43570 | 2/20 | 0.48 |
| ▸ | CA1 | P00915 | 2/20 | 0.48 |
| ▸ | CA2 | P00918 | 2/20 | 0.48 |
| ▸ | CA9 | Q16790 | 2/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.47 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL29443808 | 0.98 | KDM4E (0.50) | CYP2A6KDM4ELMNACYP1A2METAP1 | |
| SCHEMBL6290 | 0.98 | KDM4E (0.50) | CYP2A6KDM4ELMNACYP1A2METAP1 | |
| SCHEMBL31631020 | 0.96 | CYP2A6 (0.48) | CYP2A6KDM4ELMNACYP1A2METAP1 | |
| Hydrazine SCHEMBL7944033 | 0.94 | CA12 (0.50) | CYP2A6KDM4ELMNACYP1A2METAP1 | |
| SCHEMBL29144944 | 0.91 | CA12 (0.45) | CYP2A6KDM4ELMNACYP1A2METAP1 | |
| Dipyridyl SCHEMBL29022230 | 0.86 | KDM4E (0.47) | CYP2A6KDM4ELMNACYP1A2METAP1 | |
| SCHEMBL31099420 | 0.84 | CCR1 (0.50) | CYP2A6KDM4ELMNACYP1A2METAP1 | |
| SCHEMBL29984274 | 0.83 | KDM4E (0.68) | CYP2A6KDM4ELMNACYP1A2METAP1 | |
| SCHEMBL13458076 | 0.83 | KDM4E (0.68) | CYP2A6KDM4ELMNACYP1A2METAP1 | |
| SCHEMBL2625141 | 0.83 | CYP2A6 (0.47) | CYP2A6KDM4ELMNACYP1A2METAP1 |
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-2015002392-A1 | ORGANIC COMPOUND AND ORGANIC ELECTROLUMINESCENT ELEMENT COMPRISING SAME | 주식회사 두산 (KR) | 2015-01-08 | — | — | WO | disclosed |