Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TNF | P01375 | 10/20 | 0.57 |
| ▸ | LMNA | P02545 | 3/20 | 0.40 |
| ▸ | PDE4A | P27815 | 3/20 | 0.40 |
| ▸ | PDE4B | Q07343 | 2/20 | 0.40 |
| ▸ | PDE4C | Q08493 | 2/20 | 0.40 |
| ▸ | PDE4D | Q08499 | 2/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.40 |
| ▸ | NFKB1 | P19838 | 2/20 | 0.40 |
| ▸ | ACHE | P22303 | 2/20 | 0.40 |
| ▸ | PMP22 | Q01453 | 2/20 | 0.40 |
| ▸ | USP2 | O75604 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.40 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.40 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.38 |
| ▸ | ESR1 | P03372 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | BLM | P54132 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL6779575 | 0.88 | TNF (0.55) | TNFLMNAPDE4APDE4BPDE4C | |
| SCHEMBL6347000 | 0.79 | ADORA2A (0.50) | TNFLMNAPDE4APDE4BPDE4C | |
| SCHEMBL681591 | 0.79 | ADORA2A (0.50) | TNFLMNAPDE4APDE4BPDE4C | |
| SCHEMBL681596 | 0.79 | ADORA2A (0.50) | TNFLMNAPDE4APDE4BPDE4C | |
| SCHEMBL6780935 | 0.79 | ADORA2B (0.66) | TNFLMNAPDE4APDE4BPDE4C | |
| SCHEMBL6778207 | 0.79 | ADORA2B (0.66) | TNFLMNAPDE4APDE4BPDE4C | |
| SCHEMBL8686678 | 0.79 | ADORA2B (0.66) | TNFLMNAPDE4APDE4BPDE4C | |
| SCHEMBL6779520 | 0.79 | ADORA2B (0.66) | TNFLMNAPDE4APDE4BPDE4C | |
| SCHEMBL6777369 | 0.79 | ADORA2B (0.66) | TNFLMNAPDE4APDE4BPDE4C | |
| SCHEMBL6774460 | 0.79 | ADORA2B (0.66) | TNFLMNAPDE4APDE4BPDE4C |
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 |
|---|---|---|---|---|---|---|---|
| US-6121270-A | N-(EPOXYALKYL)XANTHINE DERIVATIVES WHICH MODULATE CELLULAR RESPONSES TO NOXIOUS, PRO-INFLAMMATORY STIMULI | CELL THERAPEUTICS, INC. (US) | 2000-09-19 | — | — | US | disclosed |
| US-5866576-A | COMPOUNDS THAT ACT AS DRUGS ON THE CELLULAR AND BIOCHEMICAL LEVEL TO MODULATE CELLULAR RESPONSES TO NOXIOUS, PRO-INFLAMMATORY STIMULI. | CELL THERAPEUTICS, INC. (US) | 1999-02-02 | — | — | US | disclosed |