Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOS3 | P29474 | 2/20 | 0.39 |
| ▸ | NOS1 | P29475 | 2/20 | 0.39 |
| ▸ | NOS2 | P35228 | 2/20 | 0.39 |
| ▸ | TLR8 | Q9NR97 | 1/20 | 0.39 |
| ▸ | TLR7 | Q9NYK1 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | CASP6 | P55212 | 1/20 | 0.38 |
| ▸ | NQO2 | P16083 | 2/20 | 0.38 |
| ▸ | EGFR | P00533 | 1/20 | 0.38 |
| ▸ | MELK | Q14680 | 2/20 | 0.38 |
| ▸ | NCF1 | P14598 | 1/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.37 |
| ▸ | PLAU | P00749 | 1/20 | 0.37 |
| ▸ | DHFR | P00374 | 1/20 | 0.36 |
| ▸ | CGAS | Q8N884 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL20637599 | 0.74 | TLR8 (0.40) | TLR8TLR7KDM4ELMNAPOLB | |
| SCHEMBL29198383 | 0.69 | PDPK1 (0.40) | TLR7KDM4ELMNANQO2NCF1 | |
| SCHEMBL5718810 | 0.68 | ALDH1A1 (0.45) | NOS3NOS1NOS2TLR8TLR7 | |
| SCHEMBL3951373 | 0.68 | KDM4E (0.46) | TLR8TLR7KDM4ELMNAPOLB | |
| Quinazoline-2,4,6-Triamine SCHEMBL335027 | 0.67 | DCPS (0.57) | DHFR | |
| Quinazoline-2,4,6-Triamine SCHEMBL30050079 | 0.67 | DCPS (0.57) | DHFR | |
| SCHEMBL17653287 | 0.67 | HTT (0.49) | KDM4ELMNACYP1A2CYP2D6 | |
| SCHEMBL29066337 | 0.66 | ALDH1A1 (0.43) | NOS3NOS1NOS2TLR8TLR7 | |
| SCHEMBL5909861 | 0.66 | MCHR1 (0.52) | — | |
| SCHEMBL4926496 | 0.66 | MAPT (0.56) | KDM4ELMNAPOLB |
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-2012046207-A1 | ANTI-PARASITIC SUBSTITUTED RING FUSED AZINE COMPOUNDS | PARACO TECHNOLOGY LIMITED (NZ) | 2012-04-12 | — | — | WO | disclosed |