Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES1 | P23141 | 6/20 | 0.37 |
| ▸ | CES2 | O00748 | 5/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.34 |
| ▸ | TP53 | P04637 | 2/20 | 0.34 |
| ▸ | TSHR | P16473 | 2/20 | 0.34 |
| ▸ | CA1 | P00915 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.33 |
| ▸ | SPHK2 | Q9NRA0 | 1/20 | 0.32 |
| ▸ | SPHK1 | Q9NYA1 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | FAAH | O00519 | 1/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.32 |
| ▸ | SOAT1 | P35610 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.31 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL21681130 | 0.80 | ALDH1A1 (0.31) | ALDH1A1ALOX15 | |
| SCHEMBL28515779 | 0.79 | — | — | |
| SCHEMBL1298659 | 0.78 | CES1 (0.44) | CES1CES2ALDH1A1TP53TSHR | |
| SCHEMBL27450779 | 0.76 | CES1 (0.35) | CES1CES2ALDH1A1TP53TSHR | |
| SCHEMBL737740 | 0.76 | CES1 (0.42) | CES1CES2ALDH1A1TP53TSHR | |
| SCHEMBL2172442 | 0.76 | CES1 (0.42) | CES1CES2ALDH1A1TP53TSHR | |
| SCHEMBL10579259 | 0.76 | TSHR (0.42) | CES1CES2ALDH1A1TP53TSHR | |
| Ethylene SCHEMBL9299137 | 0.76 | CES1 (0.42) | CES1CES2ALDH1A1TP53TSHR | |
| SCHEMBL6916133 | 0.76 | CES1 (0.46) | CES1CES2ALDH1A1TP53TSHR | |
| SCHEMBL28119298 | 0.75 | TSHR (0.43) | CES1CES2ALDH1A1TP53TSHR |
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-2009088494-A1 | IMAGE RECORDING MEDIA AND IMAGE LAYERS | HEWLETT-PACKARD DEVELOPMENT COMPANY, L.P. (US) | 2009-07-16 | — | — | WO | disclosed |