Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TYMS | P04818 | 12/20 | 0.61 |
| ▸ | CES1 | P23141 | 2/20 | 0.43 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.43 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.39 |
| ▸ | CES2 | O00748 | 1/20 | 0.39 |
| ▸ | BCHE | P06276 | 1/20 | 0.39 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 2/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | TP53 | P04637 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | CASP1 | P29466 | 1/20 | 0.38 |
| ▸ | CASP7 | P55210 | 1/20 | 0.38 |
| ▸ | HIF1A | Q16665 | 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 | |
|---|---|---|---|---|
| SCHEMBL15119578 | 0.87 | TYMS (0.50) | TYMSCES1ALOX15TDP1ALOX5 | |
| SCHEMBL580216 | 0.80 | CES1 (0.65) | TYMSCES1ALOX15TDP1ALOX5 | |
| SCHEMBL10771124 | 0.79 | TYMS (0.53) | TYMSCES1ALOX15TDP1 | |
| SCHEMBL503034 | 0.79 | TYMS (0.53) | TYMSCES1ALOX15TDP1TSHR | |
| 1,8-Naphthalic Anhydride SCHEMBL29351054 | 0.77 | TYMS (1.00) | TYMSCES1ALOX15TDP1ALDH1A1 | |
| 1,8-Naphthalic Anhydride SCHEMBL30415 | 0.77 | TYMS (1.00) | TYMSCES1ALOX15TDP1ALDH1A1 | |
| SCHEMBL13316930 | 0.76 | TYMS (0.55) | TYMSCES1ALOX15TDP1ALDH1A1 | |
| SCHEMBL4960941 | 0.76 | TYMS (0.64) | TYMS | |
| SCHEMBL24316703 | 0.75 | TYMS (0.44) | TYMSALOX15TDP1ALOX5CYP1A2 | |
| 1,8-Naphthalic Anhydride SCHEMBL6929962 | 0.74 | TYMS (0.95) | TYMSCES1ALOX15TDP1ALDH1A1 |
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-2011138021-A2 | PHOTOACTIVE COMPONENT COMPRISING ORGANIC LAYERS | HELIATEK GMBH (DE) | 2011-11-10 | — | — | WO | disclosed |