Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.39 |
| ▸ | CYP2E1 | P05181 | 2/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.39 |
| ▸ | CYP2C8 | P10632 | 2/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.39 |
| ▸ | CYP2B6 | P20813 | 2/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.39 |
| ▸ | CA2 | P00918 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.39 |
| ▸ | DRD2 | P14416 | 9/20 | 0.38 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 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 | |
|---|---|---|---|---|
| SCHEMBL705545 | 0.81 | KDM4E (0.59) | KDM4ECA2MEN1POLBMAPK1 | |
| Hydrochloric Acid SCHEMBL3859534 | 0.79 | KDM4E (0.57) | KDM4ECA2MEN1POLBMAPK1 | |
| SCHEMBL878695 | 0.70 | CA12 (0.59) | KDM4ECA2MEN1POLBKMT2A | |
| SCHEMBL18850187 | 0.69 | ACHE (0.46) | KDM4ECA2MEN1POLBMAPK1 | |
| SCHEMBL25903858 | 0.65 | KDM4E (0.58) | KDM4EMEN1POLBKMT2AALDH1A1 | |
| SCHEMBL25903978 | 0.65 | KDM4E (0.55) | KDM4ECA2MEN1POLBKMT2A | |
| SCHEMBL24338757 | 0.65 | CA12 (0.48) | KDM4ECA2MAPK1DRD2ACHE | |
| SCHEMBL18892613 | 0.65 | CA12 (0.48) | KDM4EMAPK1DRD2ACHEMAOB | |
| SCHEMBL18508007 | 0.65 | CA12 (0.48) | KDM4ECYP1A2CYP3A4CYP2C19MEN1 | |
| SCHEMBL13532787 | 0.65 | PDE3B (0.48) | KDM4EMAPK1KMT2AALDH1A1DRD2 |
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 |
|---|---|---|---|---|---|---|---|
| CN-106061966-A | Bicyclic heterocyclic derivatives as bromodomain inhibitors | 奥赖恩公司 | 2016-10-26 | — | — | CN | disclosed |