Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NUDT1 | P36639 | 1/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.47 |
| ▸ | HPGD | P15428 | 2/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.45 |
| ▸ | TSHR | P16473 | 2/20 | 0.45 |
| ▸ | MEN1 | O00255 | 2/20 | 0.43 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.43 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | CLEC4M | Q9H2X3 | 1/20 | 0.41 |
| ▸ | JAK2 | O60674 | 1/20 | 0.41 |
| ▸ | JAK3 | P52333 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
| ▸ | ATM | Q13315 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 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 | |
|---|---|---|---|---|
| SCHEMBL986438 | 0.83 | IKBKB (0.41) | ALDH1A1KDM4ETSHRLMNA | |
| SCHEMBL12583878 | 0.79 | TSHR (0.50) | NUDT1ALDH1A1KDM4EHPGDKMT2A | |
| SCHEMBL2885005 | 0.79 | KEAP1 (0.58) | NUDT1ALDH1A1KDM4EHPGDKMT2A | |
| SCHEMBL30050554 | 0.76 | KEAP1 (0.58) | ALDH1A1KDM4EHPGDKMT2AMEN1 | |
| SCHEMBL3425595 | 0.76 | KEAP1 (0.58) | ALDH1A1KDM4EHPGDKMT2AMEN1 | |
| SCHEMBL988113 | 0.75 | KDM4E (0.46) | NUDT1ALDH1A1KDM4EHPGDKMT2A | |
| SCHEMBL618995 | 0.75 | ALDH1A1 (0.46) | NUDT1ALDH1A1KDM4EHPGDKMT2A | |
| SCHEMBL12583934 | 0.75 | KDM4E (0.51) | NUDT1ALDH1A1KDM4EHPGDKMT2A | |
| SCHEMBL14786218 | 0.75 | KMT2A (0.49) | NUDT1ALDH1A1KDM4EHPGDKMT2A | |
| SCHEMBL29800264 | 0.74 | PDPK1 (0.59) | KDR |
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-2247594-A1 | PYRROLOPYRIMIDINECARBOXAMIDES | Nycomed GmbH (DE) | 2010-11-10 | — | — | EP | disclosed |
| WO-2009106531-A1 | PYRROLOPYRIMIDINECARBOXAMIDES | NYCOMED GMBH (DE) | 2009-09-03 | — | — | WO | disclosed |
| CN-101001859-A | Pyrrolopyridine derivatives | GLAXO GROUP LTD (GB) | 2007-07-18 | — | — | CN | disclosed |