Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.46 |
| ▸ | HPGD | P15428 | 1/20 | 0.46 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.46 |
| ▸ | NOTUM | Q6P988 | 8/20 | 0.43 |
| ▸ | TSHR | P16473 | 2/20 | 0.40 |
| ▸ | TP53 | P04637 | 1/20 | 0.40 |
| ▸ | CASP1 | P29466 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | G6PD | P11413 | 1/20 | 0.39 |
| ▸ | CASP7 | P55210 | 1/20 | 0.39 |
| ▸ | CASP6 | P55212 | 1/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | CLCN2 | P51788 | 1/20 | 0.38 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.38 |
| ▸ | RXRA | P19793 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL21776979 | 0.81 | NOTUM (0.56) | ALDH1A1KDM4EHPGDHSD17B10NOTUM | |
| SCHEMBL24276000 | 0.80 | NOTUM (0.44) | ALDH1A1KDM4EHPGDHSD17B10NOTUM | |
| SCHEMBL29625097 | 0.80 | NOTUM (0.44) | ALDH1A1KDM4EHPGDHSD17B10NOTUM | |
| SCHEMBL29625095 | 0.80 | NOTUM (0.44) | ALDH1A1KDM4EHPGDHSD17B10NOTUM | |
| SCHEMBL24275901 | 0.79 | NOTUM (0.47) | ALDH1A1KDM4EHPGDHSD17B10NOTUM | |
| SCHEMBL3531722 | 0.79 | RXRB (0.47) | ALDH1A1KDM4EHPGDHSD17B10NOTUM | |
| SCHEMBL30462473 | 0.78 | TSHR (0.45) | ALDH1A1KDM4EHPGDHSD17B10TSHR | |
| SCHEMBL18980394 | 0.77 | ALDH1A1 (0.48) | ALDH1A1KDM4ETSHRTP53CASP1 | |
| SCHEMBL1579844 | 0.76 | NOTUM (0.41) | ALDH1A1KDM4EHPGDHSD17B10NOTUM | |
| SCHEMBL14358945 | 0.76 | ALDH1A1 (0.44) | ALDH1A1KDM4EHPGDHSD17B10NOTUM |
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-106810535-A | One class substituted benzene formyl amine derivative, its preparation method and application | 浙江省化工研究院有限公司 | 2017-06-09 | — | — | CN | disclosed |