Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC22A12 | Q96S37 | 2/20 | 0.43 |
| ▸ | NNMT | P40261 | 1/20 | 0.40 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.39 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.39 |
| ▸ | CXCR2 | P25025 | 2/20 | 0.38 |
| ▸ | CA1 | P00915 | 2/20 | 0.37 |
| ▸ | CA2 | P00918 | 2/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.37 |
| ▸ | CXCR1 | P25024 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL16559590 | 0.89 | NFE2L2 (0.40) | SLC22A12PTGS1PTGS2CXCR2CA1 | |
| SCHEMBL7952665 | 0.88 | CA1 (0.39) | CXCR2CA1CA2CXCR1LMNA | |
| SCHEMBL22852596 | 0.83 | NNMT (0.42) | SLC22A12NNMTCA1CA2KDM4E | |
| SCHEMBL31039780 | 0.81 | NNMT (0.43) | SLC22A12NNMTCA1CA2KDM4E | |
| SCHEMBL15959129 | 0.80 | CYP2A6 (0.45) | SLC22A12PTGS1PTGS2 | |
| SCHEMBL752015 | 0.79 | CXCR2 (0.39) | SLC22A12PTGS2CXCR2CA1CA2 | |
| SCHEMBL6852624 | 0.79 | CA1 (0.40) | CXCR2CA1CA2CXCR1 | |
| SCHEMBL1473557 | 0.77 | PTPRZ1 (0.38) | CXCR2CA1CA2CXCR1LMNA | |
| SCHEMBL1997269 | 0.76 | CA1 (0.57) | CXCR2CA1CA2CXCR1 | |
| SCHEMBL2749231 | 0.76 | NPC1 (0.47) | PTGS2CA1CA2KDM4ELMNA |
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-2020189540-A1 | METHOD FOR PREPARING AROMATIC AMINO ACID DERIVATIVE | 中外製薬株式会社 | 2020-09-24 | — | — | WO | disclosed |