Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.46 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.46 |
| ▸ | POLB | P06746 | 1/20 | 0.46 |
| ▸ | TSHR | P16473 | 3/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | PPARA | Q07869 | 5/20 | 0.41 |
| ▸ | PPARG | P37231 | 3/20 | 0.41 |
| ▸ | BID | P55957 | 3/20 | 0.41 |
| ▸ | MCL1 | Q07820 | 3/20 | 0.41 |
| ▸ | BCL2L1 | Q07817 | 2/20 | 0.41 |
| ▸ | BAK1 | Q16611 | 2/20 | 0.41 |
| ▸ | KAT8 | Q9H7Z6 | 2/20 | 0.41 |
| ▸ | EP300 | Q09472 | 1/20 | 0.41 |
| ▸ | KAT2A | Q92830 | 1/20 | 0.41 |
| ▸ | KAT2B | Q92831 | 1/20 | 0.41 |
| ▸ | KAT5 | Q92993 | 1/20 | 0.41 |
| ▸ | SAE1 | Q9UBE0 | 1/20 | 0.41 |
| ▸ | RARB | P10826 | 1/20 | 0.40 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL7723904 | 0.83 | ALDH1A1 (0.54) | ALDH1A1HSD17B10KDM4EPOLBTSHR | |
| SCHEMBL28816668 | 0.82 | KDM4E (0.45) | ALDH1A1KDM4ETSHRLMNAPPARA | |
| SCHEMBL6912125 | 0.81 | TSHR (0.45) | ALDH1A1HSD17B10TSHRLMNARARB | |
| SCHEMBL30484209 | 0.80 | TSHR (0.47) | ALDH1A1HSD17B10KDM4EPOLBTSHR | |
| SCHEMBL9656582 | 0.80 | TSHR (0.47) | ALDH1A1HSD17B10KDM4EPOLBTSHR | |
| SCHEMBL7734027 | 0.80 | PLK1 (0.43) | ALDH1A1POLBTSHRLMNAPPARA | |
| SCHEMBL5964686 | 0.80 | TSHR (0.44) | ALDH1A1HSD17B10KDM4ETSHRLMNA | |
| SCHEMBL4628610 | 0.80 | TSHR (0.44) | ALDH1A1HSD17B10TSHRLMNAPPARA | |
| SCHEMBL17774730 | 0.79 | BID (0.56) | HSD17B10KDM4EPPARAPPARGBID | |
| SCHEMBL9516289 | 0.79 | PPARA (0.51) | ALDH1A1PPARAPPARGBIDMCL1 |
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 |
|---|---|---|---|---|---|---|---|
| US-6399318-B1 | ANTIGEN WHICH IS CONJUGATE OF CARRIER PROTEIN AND PHTHALIC ACID ESTER OF DEFINED STRUCTURE; FOR DETECTION AND MEASUREMENT OF PLASTICIZERS IN ENVIRONMENT | OTSUKA PHARMACEUTICAL CO., LTD. (JP) | 2002-06-04 | — | — | US | disclosed |