Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 2/20 | 0.44 |
| ▸ | NPC1 | O15118 | 1/20 | 0.44 |
| ▸ | RAB9A | P51151 | 1/20 | 0.44 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.43 |
| ▸ | HSD17B1 | P14061 | 2/20 | 0.42 |
| ▸ | RXRA | P19793 | 2/20 | 0.37 |
| ▸ | RARB | P10826 | 2/20 | 0.37 |
| ▸ | RARG | P13631 | 2/20 | 0.37 |
| ▸ | S100A4 | P26447 | 1/20 | 0.37 |
| ▸ | PGR | P06401 | 2/20 | 0.37 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | KCNJ1 | P48048 | 1/20 | 0.33 |
| ▸ | HTR7 | P34969 | 1/20 | 0.33 |
| ▸ | HTR2B | P41595 | 1/20 | 0.33 |
| ▸ | RXRB | P28702 | 1/20 | 0.33 |
| ▸ | RXRG | P48443 | 1/20 | 0.33 |
| ▸ | AVPR2 | P30518 | 2/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL15040977 | 0.89 | MAPT (0.53) | MAPTNPC1RAB9APDK2HSD17B1 | |
| SCHEMBL15040998 | 0.85 | MAPT (0.57) | MAPTNPC1RAB9APDK2HSD17B1 | |
| SCHEMBL15040961 | 0.84 | MAPT (0.52) | MAPTNPC1RAB9APDK2HSD17B1 | |
| SCHEMBL5056728 | 0.81 | PDK2 (0.60) | MAPTNPC1RAB9APDK2HSD17B1 | |
| SCHEMBL15040935 | 0.81 | AVPR2 (0.40) | PDK2RXRARARBRARGHTR7 | |
| SCHEMBL18900574 | 0.79 | PDK2 (0.44) | NPC1PDK2RXRARARBRARG | |
| SCHEMBL15040978 | 0.79 | MAPT (0.53) | MAPTNPC1RAB9APDK2HSD17B1 | |
| SCHEMBL15040933 | 0.78 | AVPR2 (0.38) | MAPTPDK2RXRARARBRARG | |
| SCHEMBL236472 | 0.78 | PDK2 (0.63) | MAPTNPC1RAB9APDK2HSD17B1 | |
| SCHEMBL30705226 | 0.78 | PDK2 (0.63) | MAPTNPC1RAB9APDK2HSD17B1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2791275-B1 | ORGANIC SENSITIZERS FOR UP-CONVERSION | MERCK PATENT GMBH (DE) | 2017-05-31 | — | — | EP | disclosed |