Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NQO1 | P15559 | 1/20 | 0.50 |
| ▸ | NPC1 | O15118 | 3/20 | 0.46 |
| ▸ | HPGD | P15428 | 2/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.46 |
| ▸ | RAB9A | P51151 | 2/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.46 |
| ▸ | TP53 | P04637 | 1/20 | 0.46 |
| ▸ | LTA4H | P09960 | 1/20 | 0.44 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.42 |
| ▸ | XDH | P47989 | 1/20 | 0.41 |
| ▸ | RELA | Q04206 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | RXRA | P19793 | 1/20 | 0.40 |
| ▸ | RXRB | P28702 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL27468361 | 0.86 | CYP2D6 (0.54) | NPC1HPGDSMN1; SMN2KDM4ERAB9A | |
| SCHEMBL27572392 | 0.83 | RXRA (0.51) | HPGDSMN1; SMN2KDM4ERAB9AALDH1A1 | |
| SCHEMBL694218 | 0.79 | ABL1 (0.48) | NPC1SMN1; SMN2KDM4ERAB9AALDH1A1 | |
| SCHEMBL21052761 | 0.79 | CTSA (0.38) | NPC1HPGDSMN1; SMN2KDM4ERAB9A | |
| SCHEMBL128508 | 0.79 | — | — | |
| SCHEMBL28981683 | 0.79 | NQO1 (0.61) | NQO1NPC1HPGDSMN1; SMN2KDM4E | |
| SCHEMBL158260 | 0.79 | NQO1 (0.61) | NQO1NPC1HPGDSMN1; SMN2KDM4E | |
| SCHEMBL920898 | 0.79 | LTA4H (0.63) | NQO1SMN1; SMN2TP53LTA4HTSHR | |
| SCHEMBL9152440 | 0.78 | LTA4H (0.68) | NQO1NPC1HPGDSMN1; SMN2KDM4E | |
| SCHEMBL12726668 | 0.78 | LTA4H (0.68) | NQO1NPC1HPGDSMN1; SMN2KDM4E |
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-2020046206-A1 | COMPOSITE MATERIALS CONTAINING PHOSPHORS FOR ENHANCED PHOTOSYNTHESIS | NANYANG TECHNOLOGICAL UNIVERSITY (SG) | 2020-03-05 | — | — | WO | disclosed |