Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 2/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 6/20 | 0.41 |
| ▸ | MAPT | P10636 | 5/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.41 |
| ▸ | PABPC1 | P11940 | 1/20 | 0.41 |
| ▸ | CYP2A6 | P11509 | 2/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.36 |
| ▸ | HIF1A | Q16665 | 3/20 | 0.36 |
| ▸ | EPAS1 | Q99814 | 3/20 | 0.36 |
| ▸ | CES2 | O00748 | 2/20 | 0.36 |
| ▸ | KDM1A | O60341 | 2/20 | 0.36 |
| ▸ | CES1 | P23141 | 2/20 | 0.36 |
| ▸ | PTPN6 | P29350 | 2/20 | 0.36 |
| ▸ | BLM | P54132 | 2/20 | 0.36 |
| ▸ | PTPN11 | Q06124 | 2/20 | 0.36 |
| ▸ | EED | O75530 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | SUZ12 | Q15022 | 1/20 | 0.36 |
| ▸ | EZH2 | Q15910 | 1/20 | 0.36 |
| ▸ | NSD1 | Q96L73 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL19861693 | 0.87 | PLA2G2A (0.38) | CYP1A2KDM4EMAPTSMN1; SMN2PABPC1 | |
| SCHEMBL19227534 | 0.86 | MAOA (0.41) | KDM4EMAPTSMN1; SMN2TDP1ALDH1A1 | |
| SCHEMBL23989039 | 0.85 | KDM4E (0.49) | CYP1A2KDM4EMAPTSMN1; SMN2PABPC1 | |
| SCHEMBL20363781 | 0.82 | HPGD (0.46) | KDM4EMAPTSMN1; SMN2TDP1ALDH1A1 | |
| SCHEMBL22881836 | 0.80 | CRHBP (0.43) | CYP1A2KDM4EMAPTSMN1; SMN2PABPC1 | |
| SCHEMBL20363665 | 0.79 | CDC14B (0.42) | KDM4EMAPTSMN1; SMN2ALDH1A1HPGD | |
| SCHEMBL21881115 | 0.79 | TDP1 (0.42) | KDM4EMAPTSMN1; SMN2TDP1ALDH1A1 | |
| SCHEMBL2380918 | 0.78 | CYP1A2 (0.68) | CYP1A2KDM4EMAPTSMN1; SMN2PABPC1 | |
| SCHEMBL260441 | 0.78 | CYP1A2 (0.68) | CYP1A2KDM4EMAPTSMN1; SMN2PABPC1 | |
| SCHEMBL29416731 | 0.78 | CYP1A2 (0.68) | CYP1A2KDM4EMAPTSMN1; SMN2PABPC1 |
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 |
|---|---|---|---|---|---|---|---|
| US-9893292-B2 | Materials for organic electroluminescence devices | MERCK PATENT GMBH (DE) | 2018-02-13 | — | — | US | disclosed |