Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | CNR2 | P34972 | 2/20 | 0.41 |
| ▸ | CNR1 | P21554 | 1/20 | 0.40 |
| ▸ | CTSD | P07339 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | HDAC3 | O15379 | 3/20 | 0.32 |
| ▸ | HDAC1 | Q13547 | 3/20 | 0.32 |
| ▸ | HDAC2 | Q92769 | 3/20 | 0.32 |
| ▸ | HDAC8 | Q9BY41 | 3/20 | 0.32 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.32 |
| ▸ | CES2 | O00748 | 1/20 | 0.32 |
| ▸ | CES1 | P23141 | 1/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | FFAR3 | O14843 | 2/20 | 0.31 |
| ▸ | TSHR | P16473 | 2/20 | 0.31 |
| ▸ | CASP2 | P42575 | 1/20 | 0.31 |
| ▸ | CA12 | O43570 | 1/20 | 0.30 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL28098323 | 0.98 | ALDH1A1 (0.44) | ALDH1A1CNR2CNR1CTSDCYP1A2 | |
| SCHEMBL518644 | 0.85 | TSHR (0.38) | CNR2CNR1CYP1A2KDM4ELMNA | |
| SCHEMBL8508370 | 0.85 | CNR2 (0.58) | ALDH1A1CNR2CNR1CYP1A2CES2 | |
| SCHEMBL3229945 | 0.83 | CNR2 (0.60) | CNR2CNR1CES2CES1LMNA | |
| SCHEMBL28088445 | 0.83 | CNR2 (0.60) | CNR2CNR1CES2CES1LMNA | |
| SCHEMBL27608967 | 0.83 | CNR2 (0.60) | CNR2CNR1CES2CES1LMNA | |
| SCHEMBL11407664 | 0.83 | ALDH1A1 (0.50) | ALDH1A1CNR2CNR1CTSDHDAC3 | |
| SCHEMBL29009621 | 0.82 | CNR2 (0.59) | CNR2CNR1CES2CES1LMNA | |
| SCHEMBL29009619 | 0.82 | CNR2 (0.59) | CNR2CNR1CES2CES1LMNA | |
| SCHEMBL8058226 | 0.82 | CNR2 (0.59) | CNR2CNR1CES2CES1LMNA |
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 |
|---|---|---|---|---|---|---|---|
| CN-103682382-B | Fuel battery cathode catalyst material of a kind of Graphene modification and preparation method thereof | Anhui University of Science and Technology (CN) | 2016-02-03 | — | — | CN | disclosed |