Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.54 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.54 |
| ▸ | EPHX2 | P34913 | 2/20 | 0.44 |
| ▸ | MMP1 | P03956 | 2/20 | 0.39 |
| ▸ | MMP9 | P14780 | 2/20 | 0.39 |
| ▸ | MMP14 | P50281 | 2/20 | 0.39 |
| ▸ | MMP2 | P08253 | 3/20 | 0.39 |
| ▸ | MMP3 | P08254 | 1/20 | 0.39 |
| ▸ | CA12 | O43570 | 2/20 | 0.37 |
| ▸ | CA1 | P00915 | 2/20 | 0.37 |
| ▸ | CA2 | P00918 | 2/20 | 0.37 |
| ▸ | CA9 | Q16790 | 2/20 | 0.37 |
| ▸ | TSHR | P16473 | 2/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.36 |
| ▸ | LTA4H | P09960 | 1/20 | 0.35 |
| ▸ | TP53 | P04637 | 1/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.35 |
| ▸ | CNR1 | P21554 | 1/20 | 0.34 |
| ▸ | CNR2 | P34972 | 1/20 | 0.34 |
| ▸ | MME | P08473 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL15095581 | 0.80 | MMP2 (0.53) | EPHX2MMP1MMP9MMP14MMP2 | |
| SCHEMBL29886476 | 0.79 | ALDH1A1 (0.55) | ALDH1A1SMN1; SMN2EPHX2MMP2CA12 | |
| SCHEMBL1273086 | 0.77 | MMP2 (0.41) | ALDH1A1SMN1; SMN2EPHX2MMP1MMP9 | |
| SCHEMBL22303144 | 0.77 | MMP2 (0.41) | ALDH1A1SMN1; SMN2EPHX2MMP1MMP9 | |
| SCHEMBL8706642 | 0.77 | MMP2 (0.41) | ALDH1A1SMN1; SMN2EPHX2MMP1MMP9 | |
| SCHEMBL24946223 | 0.77 | MMP2 (0.41) | ALDH1A1SMN1; SMN2EPHX2MMP1MMP9 | |
| SCHEMBL23371625 | 0.77 | MMP1 (0.43) | EPHX2MMP1MMP9MMP14MMP2 | |
| Hydrochloric Acid SCHEMBL1021562 | 0.76 | MMP2 (0.40) | ALDH1A1SMN1; SMN2EPHX2MMP1MMP9 | |
| SCHEMBL21916665 | 0.76 | MMP1 (0.50) | MMP1MMP9MMP14MMP2MMP3 | |
| SCHEMBL5679173 | 0.75 | MMP2 (0.39) | ALDH1A1SMN1; SMN2EPHX2MMP1MMP9 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-116615411-A | Process for producing peptide compound containing N-substituted amino acid residue | 中外制药株式会社 | 2023-08-18 | — | — | CN | disclosed |
| WO-2022138891-A1 | METHOD FOR PRODUCING PEPTIDE COMPOUND CONTAINING N-SUBSTITUTED-AMINO ACID RESIDUE | 中外製薬株式会社 | 2022-06-30 | — | — | WO | disclosed |