Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 5/20 | 0.41 |
| ▸ | AGPAT2 | O15120 | 1/20 | 0.41 |
| ▸ | UTRN | P46939 | 2/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.40 |
| ▸ | POLB | P06746 | 3/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 5/20 | 0.39 |
| ▸ | RXFP1 | Q9HBX9 | 2/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.39 |
| ▸ | KDR | P35968 | 1/20 | 0.38 |
| ▸ | TP53 | P04637 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | PPARG | P37231 | 1/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.38 |
| ▸ | NR2E3 | Q9Y5X4 | 1/20 | 0.38 |
| ▸ | NCOR2 | Q9Y618 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL23033321 | 0.84 | ALDH1A1 (0.39) | PTGS2AGPAT2UTRNALDH1A1POLB | |
| SCHEMBL23033533 | 0.82 | ALDH1A1 (0.48) | PTGS2UTRNALDH1A1POLBKDM4E | |
| SCHEMBL23033326 | 0.82 | PTGS2 (0.36) | PTGS2AGPAT2UTRNALDH1A1POLB | |
| SCHEMBL23033470 | 0.82 | ACSL1 (0.40) | SMN1; SMN2NPSR1TP53 | |
| SCHEMBL30297425 | 0.81 | AGPAT2 (0.41) | PTGS2AGPAT2UTRNALDH1A1POLB | |
| SCHEMBL20469749 | 0.80 | NPC1 (0.48) | PTGS2UTRNALDH1A1POLBKDM4E | |
| SCHEMBL23033956 | 0.80 | KDM4E (0.37) | PTGS2UTRNALDH1A1POLBKDM4E | |
| SCHEMBL23033993 | 0.79 | ALDH1A1 (0.44) | ALDH1A1POLBKDM4ESMN1; SMN2NPC1 | |
| SCHEMBL23033995 | 0.79 | ALDH1A1 (0.44) | ALDH1A1POLBKDM4ESMN1; SMN2NPC1 | |
| SCHEMBL23033731 | 0.78 | ALDH1A1 (0.49) | UTRNALDH1A1POLBKDM4ESMN1; SMN2 |
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-2021032209-A1 | ANTI-INFLUENZA VIRUS COMPOUND, PREPARATION METHOD AND USE THEREOF | 四川海思科制药有限公司 | 2021-02-25 | — | — | WO | disclosed |