Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BACE1 | P56817 | 5/20 | 0.49 |
| ▸ | CFD | P00746 | 2/20 | 0.44 |
| ▸ | CYP4F2 | P78329 | 1/20 | 0.44 |
| ▸ | CYP4A11 | Q02928 | 1/20 | 0.44 |
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.43 |
| ▸ | ADORA2A | P29274 | 2/20 | 0.43 |
| ▸ | ADORA1 | P30542 | 2/20 | 0.43 |
| ▸ | CCR5 | P51681 | 1/20 | 0.43 |
| ▸ | PTGS2 | P35354 | 4/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | GLA | P06280 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | ESR1 | P03372 | 1/20 | 0.40 |
| ▸ | ITGB3 | P05106 | 1/20 | 0.40 |
| ▸ | ITGA2B | P08514 | 1/20 | 0.40 |
| ▸ | HMGB1 | P09429 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL27489237 | 0.89 | BACE1 (0.51) | BACE1CFDCYP4F2CYP4A11ADORA3 | |
| SCHEMBL11835902 | 0.83 | BACE1 (0.44) | BACE1CFDCYP4F2CYP4A11ADORA3 | |
| SCHEMBL28035132 | 0.83 | BACE1 (0.51) | BACE1CFDCYP4F2CYP4A11ADORA3 | |
| SCHEMBL27556516 | 0.81 | HTR7 (0.44) | CYP4F2CYP4A11KDM4EKMT2AALDH1A1 | |
| SCHEMBL7658162 | 0.81 | CFD (0.53) | CFDCYP4F2CYP4A11CCR5KDM4E | |
| SCHEMBL27623501 | 0.78 | CFD (0.59) | CFDCYP4F2CYP4A11CCR5PTGS2 | |
| SCHEMBL10448896 | 0.77 | BACE1 (0.41) | BACE1CYP4F2CYP4A11ADORA3ADORA2A | |
| SCHEMBL31273249 | 0.76 | BACE1 (0.61) | BACE1ADORA3ADORA2AADORA1KDM4E | |
| SCHEMBL28022867 | 0.76 | BACE1 (0.56) | BACE1ADORA3ADORA2AADORA1PTGS2 | |
| SCHEMBL11835597 | 0.76 | BACE1 (0.44) | BACE1CFDCYP4F2CYP4A11ADORA3 |
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-1066070-A | Promote the new benzo-fused lactams that tethelin discharges | MERCK & CO INC (US) | 1992-11-11 | — | — | CN | disclosed |