Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 6/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.51 |
| ▸ | GLA | P06280 | 1/20 | 0.51 |
| ▸ | GAA | P10253 | 1/20 | 0.51 |
| ▸ | ABL1 | P00519 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.42 |
| ▸ | CASP1 | P29466 | 2/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.42 |
| ▸ | MAPT | P10636 | 2/20 | 0.42 |
| ▸ | PARP1 | P09874 | 1/20 | 0.41 |
| ▸ | GABRA1 | P14867 | 3/20 | 0.41 |
| ▸ | GABRG2 | P18507 | 3/20 | 0.41 |
| ▸ | GABRB3 | P28472 | 3/20 | 0.41 |
| ▸ | GABRB2 | P47870 | 2/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | IKBKB | O14920 | 1/20 | 0.40 |
| ▸ | CHUK | O15111 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 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 | |
|---|---|---|---|---|
| SCHEMBL9939276 | 0.82 | SMN1; SMN2 (0.59) | KDM4EALDH1A1SMN1; SMN2CASP1TSHR | |
| SCHEMBL13750063 | 0.82 | TSHR (0.44) | KDM4EALDH1A1ABL1SMN1; SMN2CASP1 | |
| SCHEMBL3781236 | 0.78 | PARP1 (0.42) | KDM4EALDH1A1SMN1; SMN2TSHRHSD17B10 | |
| SCHEMBL16971638 | 0.78 | ABL1 (0.62) | KDM4EALDH1A1GLAGAAABL1 | |
| SCHEMBL3790275 | 0.77 | ALDH1A1 (0.60) | KDM4EALDH1A1GLAGAAABL1 | |
| SCHEMBL2468739 | 0.76 | KDM4E (0.55) | KDM4EALDH1A1GLAGAAABL1 | |
| SCHEMBL29506761 | 0.75 | SMN1; SMN2 (0.65) | KDM4EALDH1A1GLAGAASMN1; SMN2 | |
| SCHEMBL325007 | 0.75 | SMN1; SMN2 (0.65) | KDM4EALDH1A1GLAGAASMN1; SMN2 | |
| SCHEMBL27929753 | 0.74 | KDM4E (0.58) | KDM4EALDH1A1GLAGAAABL1 | |
| SCHEMBL12590922 | 0.74 | ALDH1A1 (0.53) | ALDH1A1SMN1; SMN2TSHRMAPTGABRB2 |
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 |