Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KEAP1 | Q14145 | 5/20 | 0.41 |
| ▸ | NFE2L2 | Q16236 | 5/20 | 0.41 |
| ▸ | MME | P08473 | 1/20 | 0.40 |
| ▸ | MMP2 | P08253 | 3/20 | 0.40 |
| ▸ | MMP3 | P08254 | 3/20 | 0.40 |
| ▸ | MMP13 | P45452 | 3/20 | 0.40 |
| ▸ | MMP1 | P03956 | 2/20 | 0.40 |
| ▸ | MMP7 | P09237 | 2/20 | 0.40 |
| ▸ | MMP9 | P14780 | 2/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | ADAMTS4 | O75173 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 4/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.37 |
| ▸ | ACHE | P22303 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.36 |
| ▸ | GAA | P10253 | 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 | |
|---|---|---|---|---|
| SCHEMBL42676 | 0.84 | TP53 (0.39) | MMECA2CA1ALDH1A1 | |
| Bicarbonate SCHEMBL28006549 | 0.82 | TP53 (0.38) | MMECA2CA1ALDH1A1 | |
| SCHEMBL27534148 | 0.82 | TP53 (0.38) | MMECA2CA1ALDH1A1 | |
| Toluene SCHEMBL8908638 | 0.73 | LMNA (0.55) | KEAP1NFE2L2MEN1NPC1RAB9A | |
| Toluene SCHEMBL25341486 | 0.72 | LMNA (0.52) | KEAP1NFE2L2MEN1NPC1RAB9A | |
| Toluene SCHEMBL27819683 | 0.71 | LMNA (0.58) | KEAP1NFE2L2MEN1NPC1RAB9A | |
| Toluene SCHEMBL27527983 | 0.71 | LMNA (0.58) | KEAP1NFE2L2MEN1NPC1RAB9A | |
| Cadaverine Tartrate SCHEMBL9732307 | 0.69 | LMNA (0.55) | KEAP1NFE2L2MEN1NPC1RAB9A | |
| Cadaverine Tartrate SCHEMBL18586007 | 0.69 | LMNA (0.55) | KEAP1NFE2L2MEN1NPC1RAB9A | |
| Toluene SCHEMBL4119715 | 0.69 | LMNA (0.55) | MEN1NPC1RAB9AKMT2ALMNA |
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-101466408-A | Polycation-polyanion complexes, compositions, and methods of use thereof | AERIS THERAPEUTICS INC (US) | 2009-06-24 | — | — | CN | disclosed |