Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA3 | P0DMS8 | 9/20 | 0.52 |
| ▸ | HSP90AA1 | P07900 | 2/20 | 0.51 |
| ▸ | CCR1 | P32246 | 3/20 | 0.47 |
| ▸ | CCR5 | P51681 | 3/20 | 0.47 |
| ▸ | CCR8 | P51685 | 3/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.47 |
| ▸ | METAP1 | P53582 | 4/20 | 0.47 |
| ▸ | LMNA | P02545 | 3/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.47 |
| ▸ | POLB | P06746 | 1/20 | 0.47 |
| ▸ | BLM | P54132 | 1/20 | 0.47 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.47 |
| ▸ | DOHH | Q9BU89 | 1/20 | 0.47 |
| ▸ | P4HTM | Q9NXG6 | 1/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.46 |
| ▸ | TP53 | P04637 | 1/20 | 0.46 |
| ▸ | ALPL | P05186 | 1/20 | 0.46 |
| ▸ | ALPI | P09923 | 1/20 | 0.46 |
| ▸ | ALPG | P10696 | 1/20 | 0.46 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL16436800 | 0.87 | DHODH (0.51) | ADORA3HSP90AA1CCR1CCR5CCR8 | |
| SCHEMBL27085343 | 0.84 | ADORA3 (0.49) | ADORA3HSP90AA1CCR1CCR5CCR8 | |
| SCHEMBL29446790 | 0.82 | KDM4E (0.53) | ADORA3KDM4ELMNAPOLBSMN1; SMN2 | |
| SCHEMBL3318116 | 0.82 | KDM4E (0.53) | ADORA3KDM4ELMNAPOLBSMN1; SMN2 | |
| SCHEMBL30616770 | 0.82 | KDM4E (0.53) | ADORA3KDM4ELMNAPOLBSMN1; SMN2 | |
| SCHEMBL16436852 | 0.79 | CYP2A6 (0.55) | KDM4ECYP1A2HIF1ASMN1; SMN2TP53 | |
| SCHEMBL13327614 | 0.79 | ALDH1A1 (0.50) | ADORA3KDM4ELMNACYP1A2POLB | |
| SCHEMBL10882283 | 0.78 | KDM4E (0.52) | ADORA3KDM4ELMNACYP1A2POLB | |
| SCHEMBL28898330 | 0.77 | CCR1 (0.51) | HSP90AA1CCR1CCR5CCR8KDM4E | |
| SCHEMBL973168 | 0.76 | ADORA3 (0.49) | ADORA3HSP90AA1CCR1CCR5CCR8 |
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 |
|---|---|---|---|---|---|---|---|
| US-4269834-A | Copper complexes of isoquinazolines | NAUTA WIJBE T | 1981-05-26 | — | — | US | disclosed |