Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR5A1 | Q13285 | 1/20 | 0.48 |
| ▸ | LTA4H | P09960 | 2/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | GPR55 | Q9Y2T6 | 1/20 | 0.40 |
| ▸ | ALDH2 | P05091 | 1/20 | 0.38 |
| ▸ | RARB | P10826 | 3/20 | 0.37 |
| ▸ | ESR1 | P03372 | 7/20 | 0.37 |
| ▸ | HTR2A | P28223 | 2/20 | 0.36 |
| ▸ | HTR2C | P28335 | 2/20 | 0.36 |
| ▸ | HTR1B | P28222 | 1/20 | 0.36 |
| ▸ | HTR2B | P41595 | 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 | |
|---|---|---|---|---|
| SCHEMBL12160874 | 0.95 | KDM4E (0.41) | NR5A1LTA4HKDM4EMAPTHTT | |
| SCHEMBL16978409 | 0.95 | KDM4E (0.41) | NR5A1LTA4HKDM4EMAPTHTT | |
| SCHEMBL17713607 | 0.81 | NR5A1 (0.42) | NR5A1LTA4HKDM4EMAPTHTT | |
| SCHEMBL16968365 | 0.79 | THRA (0.34) | KDM4EMAPTHTTGPR55RARB | |
| SCHEMBL15641171 | 0.79 | THRA (0.37) | KDM4EMAPTHTTGPR55ALDH2 | |
| SCHEMBL17713611 | 0.77 | CYP2D6 (0.41) | KDM4EMAPTHTR2AHTR2B | |
| SCHEMBL14645300 | 0.74 | CHEK1 (0.39) | MAPTHTT | |
| SCHEMBL17725550 | 0.74 | ALDH1A1 (0.39) | KDM4EMAPTHTR2AHTR2B | |
| SCHEMBL15078786 | 0.73 | CHEK1 (0.40) | KDM4EMAPTHTTGPR55 | |
| SCHEMBL16473610 | 0.71 | NR5A1 (0.73) | NR5A1LTA4HESR1 |
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-2013008951-A1 | ORGANIC DYE, DYE-SENSITIZED METAL OXIDE SEMICONDUCTOR ELECTRODE AND DYE-SENSITIZED SOLAR CELL | NATIONAL INSTITUTE FOR MATERIALS SCIENCE (JP) | 2013-01-17 | — | — | WO | disclosed |