Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES2 | O00748 | 1/20 | 0.41 |
| ▸ | CES1 | P23141 | 1/20 | 0.41 |
| ▸ | F2 | P00734 | 1/20 | 0.39 |
| ▸ | PLG | P00747 | 1/20 | 0.39 |
| ▸ | PLAU | P00749 | 1/20 | 0.39 |
| ▸ | KLKB1 | P03952 | 1/20 | 0.39 |
| ▸ | KLK1 | P06870 | 1/20 | 0.39 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.39 |
| ▸ | RAPGEF3 | O95398 | 2/20 | 0.38 |
| ▸ | RAPGEF4 | Q8WZA2 | 2/20 | 0.38 |
| ▸ | MEN1 | O00255 | 3/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.36 |
| ▸ | HPGD | P15428 | 2/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | MAPT | P10636 | 2/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.36 |
| ▸ | EGFR | P00533 | 1/20 | 0.36 |
| ▸ | TP53 | P04637 | 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 | |
|---|---|---|---|---|
| SCHEMBL26303278 | 0.80 | CES2 (0.46) | CES2CES1F2PLGPLAU | |
| SCHEMBL26303279 | 0.80 | CES2 (0.46) | CES2CES1F2PLGPLAU | |
| SCHEMBL470757 | 0.80 | CHRNB2 (0.38) | KMT2AALDH1A1MAPTMAPK1ALOX15 | |
| SCHEMBL26303256 | 0.79 | CES2 (0.44) | CES2CES1F2PLGPLAU | |
| SCHEMBL470761 | 0.78 | CHRNB2 (0.35) | F2PLGPLAUKLKB1PRSS1 | |
| SCHEMBL470756 | 0.74 | MEN1 (0.35) | MEN1KMT2ASMN1; SMN2KDM4EHPGD | |
| SCHEMBL470759 | 0.74 | ALDH1A1 (0.38) | CES2CES1KMT2ASMN1; SMN2KDM4E | |
| SCHEMBL470770 | 0.73 | KDM4E (0.34) | MEN1KMT2ASMN1; SMN2KDM4EHPGD | |
| SCHEMBL470765 | 0.73 | ALDH1A1 (0.34) | CES2CES1KMT2ASMN1; SMN2KDM4E | |
| SCHEMBL470758 | 0.72 | MAPT (0.40) | MEN1KMT2AKDM4EHPGDALDH1A1 |
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-20140144509-A1 | Compounds for Organic Photovoltaic Devices | NOVALED AG (DE) | 2014-05-29 | — | — | US | disclosed |
| WO-2012031735-A1 | COMPOUNDS FOR ORGANIC PHOTOVOLTAIC DEVICES | NOVALED AG (DE) | 2012-03-15 | — | — | WO | disclosed |