Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE10A | Q9Y233 | 2/20 | 0.48 |
| ▸ | KDR | P35968 | 4/20 | 0.47 |
| ▸ | TEK | Q02763 | 4/20 | 0.47 |
| ▸ | CTNNB1 | P35222 | 1/20 | 0.43 |
| ▸ | RAB9A | P51151 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.41 |
| ▸ | HTR2B | P41595 | 1/20 | 0.41 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.41 |
| ▸ | CDC7 | O00311 | 1/20 | 0.41 |
| ▸ | AURKA | O14965 | 1/20 | 0.40 |
| ▸ | AURKB | Q96GD4 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL16654579 | 0.80 | BCAT2 (0.53) | RAB9ACYP3A4MAPTCDC7 | |
| Hydrochloric Acid SCHEMBL30692651 | 0.77 | BCAT2 (0.50) | RAB9ACYP3A4MAPTCDC7 | |
| SCHEMBL4879222 | 0.76 | CTNNB1 (0.42) | CTNNB1RAB9AMEN1NR1I2LMNA | |
| SCHEMBL5264038 | 0.76 | PDE10A (0.51) | PDE10AKDRTEKMEN1KMT2A | |
| SCHEMBL5262512 | 0.75 | KDR (0.58) | PDE10AKDRTEKAURKAAURKB | |
| SCHEMBL6631705 | 0.75 | RAB9A (0.56) | CTNNB1RAB9AMEN1NR1I2LMNA | |
| SCHEMBL30143171 | 0.74 | PDE10A (0.59) | PDE10AKDRTEK | |
| SCHEMBL29134476 | 0.74 | KEAP1 (0.45) | CDC7AURKAAURKB | |
| SCHEMBL5260572 | 0.74 | TEK (0.52) | KDRTEKAURKAAURKBTPX2 | |
| SCHEMBL7098623 | 0.73 | IKBKB (0.43) | CDC7AURKBIRAK4 |
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-1751136-A2 | NITROGENATED HETEROCYCLIC DERIVATIVES AS PROTEIN KINASE MODULATORS AND USE FOR THE TREATMENT OF ANGIOGENESIS AND CANCER | AMGEN INC. (US) | 2007-02-14 | — | — | EP | claimed |
| WO-2005113494-A2 | NITROGENATED HETEROCYCLIC DERIVATIVES AS PROTEIN KINASE MODULATORS AND USE FOR THE TREATMENT OF ANGIOGENESIS AND CANCER | AMGEN INC. (US) | 2005-12-01 | — | — | WO | claimed |