Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 8/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 7/20 | 0.37 |
| ▸ | MAPT | P10636 | 7/20 | 0.37 |
| ▸ | RECQL | P46063 | 6/20 | 0.37 |
| ▸ | LMNA | P02545 | 4/20 | 0.37 |
| ▸ | APEX1 | P27695 | 3/20 | 0.37 |
| ▸ | BLM | P54132 | 3/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.37 |
| ▸ | MTOR | P42345 | 3/20 | 0.37 |
| ▸ | TSHR | P16473 | 2/20 | 0.37 |
| ▸ | NFKB1 | P19838 | 2/20 | 0.37 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.37 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.37 |
| ▸ | THPO | P40225 | 1/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.37 |
| ▸ | HPGD | P15428 | 3/20 | 0.35 |
| ▸ | ADRB2 | P07550 | 3/20 | 0.35 |
| ▸ | ADRB1 | P08588 | 3/20 | 0.35 |
| ▸ | ADRB3 | P13945 | 3/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL9850316 | 0.74 | ADORA2A (0.42) | MAPK1ADORA3ADORA2AADORA1ADORA2B | |
| SCHEMBL7708301 | 0.72 | CDK2 (0.53) | TDP1KDM4EMAPTRECQLLMNA | |
| SCHEMBL7148122 | 0.68 | CA1 (0.42) | TDP1KDM4EMAPTRECQLLMNA | |
| SCHEMBL7708271 | 0.68 | TDP1 (0.39) | TDP1KDM4EMAPTRECQLLMNA | |
| SCHEMBL3937368 | 0.66 | TDP1 (0.59) | TDP1KDM4EMAPTRECQLLMNA | |
| SCHEMBL15829723 | 0.65 | ADORA2A (0.37) | ADORA2AADORA1ADORA2BPI4KAPI4K2B | |
| SCHEMBL6016359 | 0.64 | CCNB2 (0.54) | MAPK1ADORA2AADORA1ADORA2BPI4KA | |
| SCHEMBL320849 | 0.62 | ADORA2A (0.41) | MAPK1ADORA2AADORA1ADORA2BPI4KA | |
| SCHEMBL667204 | 0.60 | ADORA2A (0.62) | ADORA3ADORA2AADORA1ADORA2BPI4KA | |
| SCHEMBL4455868 | 0.59 | ADORA2A (0.37) | KDM4ELMNABLMKMT2ATSHR |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1244668-A1 | PURINE DERIVATIVES, PROCESS FOR THEIR PREPARATION AND USE THEREOF | UNIVERSITAIRE INSTELLING ANTWERPEN (BE) | 2002-10-02 | — | — | EP | disclosed |
| WO-2001049688-A1 | PURINE DERIVATIVES, PROCESS FOR THEIR PREPARATION AND USE THEREOF | UNIVERSITAIRE INSTELLING ANTWERPEN (BE) | 2001-07-12 | — | — | WO | disclosed |