Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.47 |
| ▸ | NOS1 | P29475 | 2/20 | 0.47 |
| ▸ | PLAU | P00749 | 1/20 | 0.41 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.39 |
| ▸ | CYP2E1 | P05181 | 1/20 | 0.39 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | CYP2B6 | P20813 | 1/20 | 0.39 |
| ▸ | SRC | P12931 | 1/20 | 0.37 |
| ▸ | CDK2 | P24941 | 1/20 | 0.37 |
| ▸ | ZAP70 | P43403 | 1/20 | 0.37 |
| ▸ | SYK | P43405 | 1/20 | 0.37 |
| ▸ | RAB9A | P51151 | 4/20 | 0.37 |
| ▸ | GAA | P10253 | 3/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.37 |
| ▸ | NPC1 | O15118 | 3/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.37 |
| ▸ | GLA | P06280 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 2/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL18157874 | 0.73 | SMN1; SMN2 (0.55) | SMN1; SMN2NOS1PLAUPDE10ACYP3A4 | |
| SCHEMBL13680611 | 0.71 | CYP3A4 (0.51) | SMN1; SMN2NOS1PDE10ACYP3A4CYP2E1 | |
| SCHEMBL1822397 | 0.70 | SMN1; SMN2 (0.44) | SMN1; SMN2NOS1PLAUPDE10ACYP3A4 | |
| SCHEMBL13680759 | 0.70 | BACE1 (0.49) | SMN1; SMN2NOS1PLAUPDE10ACYP3A4 | |
| SCHEMBL19853525 | 0.69 | ATP4A (0.38) | SMN1; SMN2NOS1PLAUPDE10ACYP3A4 | |
| SCHEMBL18175150 | 0.69 | TSHR (0.57) | SMN1; SMN2NOS1PDE10ACYP3A4CYP2E1 | |
| SCHEMBL17407204 | 0.68 | SMN1; SMN2 (0.68) | SMN1; SMN2NOS1PDE10ACYP3A4CYP2E1 | |
| SCHEMBL890218 | 0.68 | NPC1 (0.50) | SMN1; SMN2NOS1PLAUPDE10ACYP3A4 | |
| SCHEMBL28996037 | 0.68 | PDE10A (0.42) | SMN1; SMN2NOS1PLAUPDE10ACYP3A4 | |
| SCHEMBL996759 | 0.68 | SMN1; SMN2 (0.45) | SMN1; SMN2NOS1PLAUPDE10ACYP3A4 |
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-2010045008-A1 | AMIDES OF THIENO[2,3-d]PYRIMIDINE AND THEIR USE AS ADENOSINE A2a RECEPTOR ANTAGONISTS | JANSSEN PHARMACEUTICA NV (BE) | 2010-04-22 | — | — | WO | disclosed |