Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.48 |
| ▸ | MAPT | P10636 | 5/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.48 |
| ▸ | SLC22A12 | Q96S37 | 1/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.46 |
| ▸ | LMNA | P02545 | 1/20 | 0.46 |
| ▸ | PIK3C2A | O00443 | 1/20 | 0.46 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.42 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.41 |
| ▸ | PTGDR2 | Q9Y5Y4 | 6/20 | 0.41 |
| ▸ | TSHR | P16473 | 3/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.41 |
| ▸ | CTNNB1 | P35222 | 1/20 | 0.39 |
| ▸ | WNT3A | P56704 | 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 | |
|---|---|---|---|---|
| SCHEMBL14399034 | 0.78 | LMNA (0.49) | ALDH1A1MAPTKMT2AKDM4ELMNA | |
| SCHEMBL14398657 | 0.76 | ALDH1A1 (0.58) | ALDH1A1MAPTKMT2AKDM4ELMNA | |
| SCHEMBL19079732 | 0.70 | PDE4D (0.66) | ALDH1A1MAPTKMT2AKDM4ELMNA | |
| SCHEMBL25954965 | 0.67 | SLC22A12 (0.73) | ALDH1A1KMT2ASLC22A12 | |
| SCHEMBL14398658 | 0.66 | TSHR (0.62) | ALDH1A1MAPTKMT2AKDM4ELMNA | |
| SCHEMBL21589433 | 0.66 | PIK3C2A (0.61) | ALDH1A1MAPTKMT2ALMNAPIK3C2A | |
| SCHEMBL19079775 | 0.65 | PDE4D (0.59) | ALDH1A1MAPTKDM4ELMNAPIK3C2A | |
| SCHEMBL2750480 | 0.65 | ALDH1A1 (0.74) | ALDH1A1MAPTKMT2AKDM4EPOLB | |
| SCHEMBL5479541 | 0.63 | MAPT (0.58) | ALDH1A1MAPTKMT2AKDM4ELMNA | |
| SCHEMBL24821186 | 0.63 | KDM4E (0.67) | KDM4EPTGDR2CTNNB1 |
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-2007117180-A1 | AZAHETEROCYCLES, COMBINATORY LIBRARY, FOCUSED LIBRARY, PHARMACEUTICAL COMPOSITION AND METHODS FOR THE PRODUCTION THEREOF | 'CHEMICAL DIVERSITY RESEARCH INSTITUTE' LTD. (RU) | 2007-10-18 | — | — | WO | disclosed |