Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA2A | P29274 | 6/20 | 0.64 |
| ▸ | ADORA1 | P30542 | 5/20 | 0.64 |
| ▸ | TSHR | P16473 | 4/20 | 0.50 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.50 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.50 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.50 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.50 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.50 |
| ▸ | LMNA | P02545 | 2/20 | 0.50 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.50 |
| ▸ | HTT | P42858 | 2/20 | 0.49 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.48 |
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.48 |
| ▸ | CHUK | O15111 | 1/20 | 0.47 |
| ▸ | APP | P05067 | 3/20 | 0.46 |
| ▸ | USP2 | O75604 | 1/20 | 0.46 |
| ▸ | BRD4 | O60885 | 1/20 | 0.45 |
| ▸ | MAPT | P10636 | 2/20 | 0.45 |
| ▸ | EGFR | P00533 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL6443545 | 0.81 | ADORA1 (0.63) | ADORA2AADORA1CHUKAPP | |
| SCHEMBL6445919 | 0.76 | HIF1A (0.51) | ADORA2AADORA1TSHRLMNASMN1; SMN2 | |
| SCHEMBL5040104 | 0.76 | HTT (0.47) | ADORA2AADORA1TSHRHSD17B10LMNA | |
| SCHEMBL6441963 | 0.75 | ADORA1 (0.62) | ADORA2AADORA1TSHRCYP1A2CYP3A4 | |
| SCHEMBL5040171 | 0.75 | ADORA2A (0.62) | ADORA2AADORA1HSD17B10LMNAHTT | |
| SCHEMBL6446985 | 0.75 | HTT (0.47) | ADORA2AADORA1TSHRLMNAMAPK1 | |
| SCHEMBL6442614 | 0.74 | ADORA2A (0.69) | ADORA2AADORA1TSHRCYP1A2CYP3A4 | |
| SCHEMBL5046658 | 0.74 | ADORA2A (0.54) | ADORA2AADORA1TSHRCYP1A2CYP3A4 | |
| SCHEMBL6443198 | 0.72 | ADORA2A (0.50) | ADORA2AADORA1TSHRHSD17B10LMNA | |
| SCHEMBL6440809 | 0.72 | ADORA2A (0.66) | ADORA2AADORA1TSHRHSD17B10LMNA |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1261327-B1 | ADENOSINE RECEPTOR MODULATORS | HOFFMANN LA ROCHE (CH) | 2005-04-27 | — | — | EP | disclosed |
| EP-1261327-A2 | ADENOSINE RECEPTOR MODULATORS | F.HOFFMANN-LA ROCHE AG (CH) | 2002-12-04 | — | — | EP | disclosed |
| WO-2001062233-A2 | ADENOSINE RECEPTOR MODULATORS | F. HOFFMANN LA ROCHE AG (CH) | 2001-08-30 | — | — | WO | disclosed |