Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA2A | P29274 | 15/20 | 0.38 |
| ▸ | ADORA1 | P30542 | 13/20 | 0.38 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 3/20 | 0.34 |
| ▸ | RAB9A | P51151 | 3/20 | 0.34 |
| ▸ | NPSR1 | Q6W5P4 | 3/20 | 0.34 |
| ▸ | CTDSP1 | Q9GZU7 | 2/20 | 0.34 |
| ▸ | ATM | Q13315 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 2/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.32 |
| ▸ | GLA | P06280 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL164707 | 0.86 | AXL (0.39) | ADORA2AADORA1ADORA2BNPC1RAB9A | |
| SCHEMBL163621 | 0.81 | NPC1 (0.40) | ADORA2AADORA1ADORA2BNPC1RAB9A | |
| SCHEMBL161445 | 0.76 | KDM4E (0.33) | — | |
| SCHEMBL161223 | 0.76 | CCNE2 (0.36) | ADORA2AADORA1NPC1RAB9AMAPT | |
| SCHEMBL167094 | 0.73 | PAK1 (0.48) | — | |
| SCHEMBL161307 | 0.72 | NT5E (0.32) | — | |
| SCHEMBL161346 | 0.72 | CYP3A4 (0.33) | SMN1; SMN2KMT2A | |
| SCHEMBL161614 | 0.72 | GRM2 (0.36) | MAPTALDH1A1 | |
| SCHEMBL162268 | 0.70 | PTGS2 (0.34) | — | |
| SCHEMBL18701478 | 0.70 | ADORA2A (0.56) | ADORA2AADORA1ADORA2B |
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-2611812-A1 | THIENOPYRIDINE AND THIENOPYRIMIDINE COMPOUNDS AND METHODS OF USE THEREOF | Ambit Biosciences Corporation (US) | 2013-07-10 | — | — | EP | disclosed |
| WO-2012030894-A1 | THIENOPYRIDINE AND THIENOPYRIMIDINE COMPOUNDS AND METHODS OF USE THEREOF | AMBIT BIOSCIENCES CORPORATION (US) | 2012-03-08 | — | — | WO | disclosed |