Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOS1 | P29475 | 1/20 | 0.50 |
| ▸ | ADORA1 | P30542 | 6/20 | 0.49 |
| ▸ | ADORA2A | P29274 | 5/20 | 0.49 |
| ▸ | ADORA2B | P29275 | 2/20 | 0.41 |
| ▸ | APP | P05067 | 2/20 | 0.41 |
| ▸ | BCHE | P06276 | 2/20 | 0.41 |
| ▸ | ACHE | P22303 | 2/20 | 0.41 |
| ▸ | DHFR | P00374 | 1/20 | 0.40 |
| ▸ | PIK3CG | P48736 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.38 |
| ▸ | USP2 | O75604 | 1/20 | 0.38 |
| ▸ | TP53 | P04637 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | GLA | P06280 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | CASP1 | P29466 | 1/20 | 0.38 |
| ▸ | CASP7 | P55210 | 1/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.38 |
| ▸ | MPO | P05164 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL6819013 | 0.87 | NOS1 (0.56) | NOS1ADORA1ADORA2AADORA2BDHFR | |
| SCHEMBL14704540 | 0.77 | RAD52 (0.51) | NOS1ADORA1ADORA2AADORA2BAPP | |
| SCHEMBL6811031 | 0.77 | PIK3CG (0.64) | NOS1ADORA1ADORA2ADHFRPIK3CG | |
| SCHEMBL6811620 | 0.74 | NUDT1 (0.45) | NOS1ADORA1ADORA2ADHFRPIK3CG | |
| SCHEMBL10456274 | 0.74 | NOS1 (0.43) | NOS1ADORA1ADORA2AADORA2BYTHDC1 | |
| SCHEMBL6811045 | 0.72 | NOS1 (0.41) | NOS1ADORA1ADORA2AADORA2BPIK3CG | |
| SCHEMBL16094592 | 0.71 | LMNA (0.46) | APPBCHEACHECYP1A2GAA | |
| SCHEMBL6814243 | 0.70 | ADORA1 (0.48) | NOS1ADORA1ADORA2AADORA2BDHFR | |
| Hydrochloric Acid SCHEMBL17494523 | 0.69 | LMNA (0.45) | APPBCHEACHECYP1A2GAA | |
| SCHEMBL14704531 | 0.69 | NOS1 (0.44) | NOS1ADORA1APPBCHEACHE |
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 |
|---|---|---|---|---|---|---|---|
| EP-1144412-B1 | IMMUNOSUPPRESSIVE EFFECTS OF PTERIDINE DERIVATIVES | 4 AZA BIOSCIENCE NV (BE) | 2004-09-29 | — | — | EP | claimed |