Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.40 |
| ▸ | HPGD | P15428 | 3/20 | 0.40 |
| ▸ | LMNA | P02545 | 2/20 | 0.40 |
| ▸ | NPC1 | O15118 | 2/20 | 0.40 |
| ▸ | NFKB1 | P19838 | 2/20 | 0.40 |
| ▸ | RAB9A | P51151 | 2/20 | 0.40 |
| ▸ | NFKB2 | Q00653 | 2/20 | 0.40 |
| ▸ | RELA | Q04206 | 2/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.40 |
| ▸ | S1PR2 | O95136 | 1/20 | 0.40 |
| ▸ | TP53 | P04637 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | KDM6B | O15054 | 1/20 | 0.40 |
| ▸ | KDM4C | Q9H3R0 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 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 | |
|---|---|---|---|---|
| SCHEMBL23133117 | 0.84 | CYP1A2 (0.41) | ALDH1A1SMN1; SMN2KDM4ELMNANPC1 | |
| SCHEMBL23472180 | 0.79 | ALDH1A1 (0.43) | ALDH1A1SMN1; SMN2KDM4EHPGDLMNA | |
| SCHEMBL9995834 | 0.75 | KDM6B (0.44) | ALDH1A1SMN1; SMN2KDM4EHPGDLMNA | |
| SCHEMBL18773449 | 0.75 | TLR8 (0.45) | KDM6BKDM4CL3MBTL1TLR8TLR7 | |
| SCHEMBL3678526 | 0.75 | KDM6B (0.48) | ALDH1A1SMN1; SMN2KDM4EHPGDLMNA | |
| SCHEMBL18773446 | 0.72 | ALDH1A1 (0.45) | ALDH1A1SMN1; SMN2KDM4EHPGDLMNA | |
| SCHEMBL23133101 | 0.71 | CYP1A2 (0.38) | ALDH1A1KDM4EHPGDTSHRKDM6B | |
| SCHEMBL23472589 | 0.69 | CCNB2 (0.37) | ALDH1A1SMN1; SMN2KDM4EHPGDLMNA | |
| SCHEMBL23472685 | 0.69 | TLR8 (0.49) | ALDH1A1SMN1; SMN2KDM4EHPGDLMNA | |
| SCHEMBL4582203 | 0.69 | KDM6B (0.42) | SMN1; SMN2KDM4ELMNANPSR1S1PR2 |
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-2021055849-A1 | HEADGROUP LIPID COMPOUNDS AND COMPOSITIONS FOR INTRACELLULAR DELIVERY OF THERAPEUTIC AGENTS | MODERNATX, INC. (US) | 2021-03-25 | — | — | WO | disclosed |