Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.57 |
| ▸ | NPC1 | O15118 | 1/20 | 0.57 |
| ▸ | USP2 | O75604 | 1/20 | 0.57 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.57 |
| ▸ | GLA | P06280 | 1/20 | 0.57 |
| ▸ | GAA | P10253 | 1/20 | 0.57 |
| ▸ | MAPT | P10636 | 1/20 | 0.57 |
| ▸ | HPGD | P15428 | 1/20 | 0.57 |
| ▸ | RAB9A | P51151 | 1/20 | 0.57 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.57 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.49 |
| ▸ | LMNA | P02545 | 1/20 | 0.49 |
| ▸ | PARP1 | P09874 | 2/20 | 0.49 |
| ▸ | TNKS2 | Q9H2K2 | 1/20 | 0.49 |
| ▸ | IP6K1 | Q92551 | 1/20 | 0.46 |
| ▸ | POLB | P06746 | 1/20 | 0.44 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.44 |
| ▸ | TRPV1 | Q8NER1 | 4/20 | 0.43 |
| ▸ | GRIN2D | O15399 | 1/20 | 0.43 |
| ▸ | GRIN3B | O60391 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL6947094 | 1.00 | KDM4E (0.57) | KDM4ENPC1USP2ALDH1A1GLA | |
| SCHEMBL29901768 | 0.83 | KDM4E (0.57) | KDM4ENPC1USP2ALDH1A1GLA | |
| SCHEMBL28834937 | 0.83 | KDM4E (0.57) | KDM4ENPC1USP2ALDH1A1GLA | |
| SCHEMBL23577775 | 0.81 | KDM4E (0.48) | KDM4ENPC1USP2ALDH1A1GLA | |
| SCHEMBL12438683 | 0.80 | KDM4E (0.53) | KDM4ENPC1USP2ALDH1A1GLA | |
| SCHEMBL8529995 | 0.77 | KDM4E (0.66) | KDM4ENPC1USP2ALDH1A1GLA | |
| SCHEMBL989078 | 0.76 | GRIN2D (0.40) | KDM4EALDH1A1GAAMAPTHSD17B10 | |
| SCHEMBL8199108 | 0.76 | ALDH1A1 (0.40) | KDM4EALDH1A1HPGDHSD17B10LMNA | |
| SCHEMBL988873 | 0.76 | KDM4E (0.51) | KDM4ENPC1ALDH1A1GAARAB9A | |
| SCHEMBL3478940 | 0.75 | CHRNB2 (0.46) | KDM4ENPC1ALDH1A1GLAGAA |
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 |
|---|---|---|---|---|---|---|---|
| CN-115028644-A | SOS1 inhibitor heterocyclic compounds | 首药控股(北京)股份有限公司 | 2022-09-09 | — | — | CN | disclosed |