Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BACE1 | P56817 | 2/20 | 0.77 |
| ▸ | CAPN1 | P07384 | 2/20 | 0.72 |
| ▸ | NFKB1 | P19838 | 2/20 | 0.71 |
| ▸ | JUN | P05412 | 1/20 | 0.71 |
| ▸ | NFE2L2 | Q16236 | 4/20 | 0.64 |
| ▸ | TFEB | P19484 | 1/20 | 0.62 |
| ▸ | CTSB | P07858 | 2/20 | 0.61 |
| ▸ | MAPT | P10636 | 5/20 | 0.60 |
| ▸ | APP | P05067 | 2/20 | 0.60 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.58 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.58 |
| ▸ | NPC1 | O15118 | 1/20 | 0.58 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.58 |
| ▸ | RAB9A | P51151 | 1/20 | 0.58 |
| ▸ | ATM | Q13315 | 1/20 | 0.58 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.58 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.57 |
| ▸ | MEN1 | O00255 | 2/20 | 0.57 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.57 |
| ▸ | CTSL | P07711 | 1/20 | 0.55 |
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 | |
|---|---|---|---|---|
| SCHEMBL4683661 | 0.88 | BACE1 (0.74) | BACE1CAPN1NFKB1JUNCTSB | |
| SCHEMBL4683657 | 0.88 | BACE1 (0.74) | BACE1CAPN1NFKB1JUNCTSB | |
| SCHEMBL27890681 | 0.87 | BACE1 (0.77) | BACE1CAPN1NFKB1JUNCTSB | |
| SCHEMBL27890682 | 0.87 | BACE1 (0.77) | BACE1CAPN1NFKB1JUNCTSB | |
| SCHEMBL3218840 | 0.87 | BACE1 (1.00) | BACE1CAPN1NFE2L2MAPTAPP | |
| SCHEMBL3218814 | 0.87 | BACE1 (1.00) | BACE1CAPN1NFE2L2MAPTAPP | |
| SCHEMBL5598600 | 0.83 | JUN (1.00) | CAPN1NFKB1JUNNFE2L2TFEB | |
| SCHEMBL5598598 | 0.83 | JUN (1.00) | CAPN1NFKB1JUNNFE2L2TFEB | |
| SCHEMBL14143629 | 0.82 | BACE1 (0.69) | BACE1CAPN1MAPTAPPKDM4E | |
| SCHEMBL3200576 | 0.81 | BACE1 (0.86) | BACE1CAPN1MAPTAPP |
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-2018086197-A1 | CATALYTIC ASYMMETRIC SYNTHESIS METHOD FOR CHIRAL SPINOL DERIVATE | 南方科技大学 | 2018-05-17 | — | — | WO | disclosed |