Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.59 |
| ▸ | LMNA | P02545 | 2/20 | 0.52 |
| ▸ | HTT | P42858 | 1/20 | 0.52 |
| ▸ | TSHR | P16473 | 1/20 | 0.51 |
| ▸ | RAB9A | P51151 | 5/20 | 0.51 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.51 |
| ▸ | HPGD | P15428 | 3/20 | 0.50 |
| ▸ | MAPT | P10636 | 3/20 | 0.46 |
| ▸ | MEN1 | O00255 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.46 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
| ▸ | NPC1 | O15118 | 2/20 | 0.44 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.44 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.44 |
| ▸ | RELA | Q04206 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL2560867 | 0.86 | ALDH1A1 (0.57) | ALDH1A1LMNAHTTRAB9AKDM4E | |
| SCHEMBL2554750 | 0.85 | ALDH1A1 (0.57) | ALDH1A1LMNATSHRRAB9AKDM4E | |
| SCHEMBL15330533 | 0.85 | TSHR (0.67) | ALDH1A1LMNATSHRRAB9AKDM4E | |
| SCHEMBL29952430 | 0.84 | RAB9A (0.72) | ALDH1A1TSHRRAB9AKDM4EHPGD | |
| SCHEMBL29955221 | 0.81 | PTGDR2 (0.62) | ALDH1A1HTTTSHRRAB9AKDM4E | |
| SCHEMBL1714794 | 0.81 | PTGDR2 (0.68) | ALDH1A1TSHRRAB9AKDM4EMAPT | |
| SCHEMBL29953474 | 0.81 | ALDH1A1 (0.53) | ALDH1A1LMNAHTTTSHRRAB9A | |
| SCHEMBL17182533 | 0.80 | USP2 (0.53) | ALDH1A1LMNARAB9AKDM4EHPGD | |
| SCHEMBL2558209 | 0.80 | ALDH1A1 (0.54) | ALDH1A1LMNAHTTRAB9AKDM4E | |
| SCHEMBL14075751 | 0.79 | TSHR (0.56) | ALDH1A1LMNAHTTTSHRRAB9A |
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-20220340893-A1 | BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES | NUEVOLUTION A/S (DK) | 2022-10-27 | — | — | US | disclosed |