Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IDH1 | O75874 | 1/20 | 0.44 |
| ▸ | THRB | P10828 | 2/20 | 0.35 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.34 |
| ▸ | MAP3K5 | Q99683 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | XIAP | P98170 | 1/20 | 0.33 |
| ▸ | HKDC1 | Q2TB90 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
| ▸ | SDCBP | O00560 | 1/20 | 0.33 |
| ▸ | SDC2 | P34741 | 1/20 | 0.33 |
| ▸ | P2RX3 | P56373 | 4/20 | 0.33 |
| ▸ | GRM5 | P41594 | 2/20 | 0.33 |
| ▸ | MEN1 | O00255 | 2/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL29951975 | 0.79 | POLB (0.38) | ALDH1A1HTTPOLBMEN1KMT2A | |
| SCHEMBL17517182 | 0.78 | IDH1 (0.46) | IDH1THRBP2RX7ALDH1A1KDM4E | |
| SCHEMBL7952458 | 0.78 | IDH1 (0.46) | IDH1THRBMAP3K5HTTMEN1 | |
| SCHEMBL17517176 | 0.78 | IDH1 (0.46) | IDH1THRBMAP3K5ALDH1A1KDM4E | |
| SCHEMBL17517149 | 0.78 | MAPK1 (0.48) | IDH1SDCBPSDC2GRM5MEN1 | |
| SCHEMBL24670531 | 0.78 | IDH1 (0.46) | IDH1THRBMAP3K5TSHRKMT2A | |
| SCHEMBL24671601 | 0.76 | IDH1 (0.45) | IDH1GRM5MEN1KMT2A | |
| SCHEMBL29951126 | 0.75 | PARP1 (0.39) | THRBP2RX7ALDH1A1HTTPOLB | |
| SCHEMBL29951234 | 0.75 | NOTUM (0.45) | ALDH1A1HTTKDM4EHSD17B10MEN1 | |
| SCHEMBL29957027 | 0.75 | HTT (0.44) | IDH1HTTPOLBMEN1KMT2A |
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 |