Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | L3MBTL1 | Q9Y468 | 4/20 | 0.45 |
| ▸ | NPC1 | O15118 | 2/20 | 0.45 |
| ▸ | RAB9A | P51151 | 2/20 | 0.45 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.45 |
| ▸ | HKDC1 | Q2TB90 | 1/20 | 0.45 |
| ▸ | DYRK1A | Q13627 | 5/20 | 0.44 |
| ▸ | DYRK1B | Q9Y463 | 4/20 | 0.44 |
| ▸ | DYRK2 | Q92630 | 3/20 | 0.44 |
| ▸ | LMNA | P02545 | 2/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
| ▸ | GAA | P10253 | 1/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
| ▸ | HTT | P42858 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.41 |
| ▸ | POLB | P06746 | 3/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL3173640 | 0.82 | TDP1 (0.46) | L3MBTL1NPC1RAB9ATDP1KDM4E | |
| SCHEMBL414418 | 0.82 | LMNA (0.45) | L3MBTL1NPC1RAB9ATDP1KDM4E | |
| SCHEMBL409024 | 0.81 | LMNA (0.44) | L3MBTL1NPC1RAB9ATDP1KDM4E | |
| SCHEMBL423755 | 0.79 | ALDH1A1 (0.44) | L3MBTL1NPC1RAB9ATDP1KDM4E | |
| SCHEMBL3188991 | 0.78 | KMT2A (0.54) | L3MBTL1NPC1RAB9ATDP1KDM4E | |
| SCHEMBL413327 | 0.78 | L3MBTL1 (0.43) | L3MBTL1NPC1RAB9ATDP1KDM4E | |
| SCHEMBL21091414 | 0.76 | GAA (0.57) | L3MBTL1NPC1RAB9ATDP1KDM4E | |
| SCHEMBL3201343 | 0.76 | L3MBTL1 (0.50) | L3MBTL1TDP1CYP3A4CYP2C19ALDH1A1 | |
| SCHEMBL3201325 | 0.76 | L3MBTL1 (0.50) | L3MBTL1TDP1CYP3A4CYP2C19ALDH1A1 | |
| SCHEMBL3180629 | 0.76 | TSHR (0.53) | NPC1RAB9AKDM4ELMNACYP3A4 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2408769-A1 | PYRIMIDINE DERIVATIVES USED AS ITK INHIBITORS | Glaxo Group Limited (GB) | 2012-01-25 | — | — | EP | disclosed |
| WO-2011110575-A1 | DERIVATIVES OF 2-[2-(BENZO- OR PYRIDO-) THIAZOLYLAMINO]-6-AMINOPYRIDINE, USEFUL IN THE TREATMENT OF RESPIRATORIC, ALLERGIC OR INFLAMMATORY DISEASES | GLAXO GROUP LIMITED (GB) | 2011-09-15 | — | — | WO | disclosed |
| WO-2010106016-A1 | PYRIMIDINE DERIVATIVES USED AS ITK INHIBITORS | GLAXO GROUP LIMITED (GB) | 2010-09-23 | — | — | WO | disclosed |