Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 10/20 | 0.52 |
| ▸ | KDM4E | B2RXH2 | 8/20 | 0.52 |
| ▸ | HPGD | P15428 | 4/20 | 0.52 |
| ▸ | SQOR | Q9Y6N5 | 1/20 | 0.47 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.46 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.46 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.45 |
| ▸ | TSHR | P16473 | 3/20 | 0.45 |
| ▸ | MEN1 | O00255 | 2/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.44 |
| ▸ | BLM | P54132 | 1/20 | 0.44 |
| ▸ | HTT | P42858 | 2/20 | 0.43 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.41 |
| ▸ | LMNA | P02545 | 3/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.40 |
| ▸ | MAPT | P10636 | 2/20 | 0.40 |
| ▸ | ATM | Q13315 | 1/20 | 0.40 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.40 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 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 | |
|---|---|---|---|---|
| SCHEMBL6110675 | 0.83 | CRHR1 (0.47) | ALDH1A1KDM4EADORA2AADORA1HSD17B10 | |
| SCHEMBL6110296 | 0.80 | KDM4E (0.38) | ALDH1A1KDM4EHPGDADORA2AADORA1 | |
| SCHEMBL5809944 | 0.76 | PDE4B (0.51) | ALDH1A1KDM4EHPGDSQORADORA2A | |
| SCHEMBL6112336 | 0.73 | ADORA2A (0.50) | ALDH1A1KDM4EHPGDSQORADORA2A | |
| SCHEMBL23066466 | 0.73 | ALDH1A1 (0.61) | ALDH1A1KDM4EHPGDHSD17B10TSHR | |
| SCHEMBL17971412 | 0.70 | ALDH1A1 (0.52) | ALDH1A1KDM4EHPGDSQORADORA2A | |
| SCHEMBL6253695 | 0.69 | KDM4E (1.00) | ALDH1A1KDM4EHPGDADORA2AADORA1 | |
| SCHEMBL6109551 | 0.68 | KDM4E (0.51) | ALDH1A1KDM4EHPGDADORA2AADORA1 | |
| SCHEMBL14983662 | 0.67 | CYP1A2 (0.51) | ALDH1A1KDM4EHPGDHSD17B10TSHR | |
| SCHEMBL8802694 | 0.66 | KDM4E (0.48) | ALDH1A1KDM4EHPGDSQORADORA2A |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2006010568-A2 | SUBSTITUTED PYRIDO[3',2':4,5]THIENO[3,2-D]PYRIMIDINE-2,4(1 H,3H)-DIONES AND -4(3H)-ONES, PYRIDO[3',2':4,5]FURO[3,2-D]PYRIMIDINE-2,4(1 H,3H)-DIONES AND -4(3H)-ONES, AND USE THEREOF AS INHIBITORS OF TNF-ALPHA RELEASE | CURACYTE DISCOVERY GMBH (DE) | 2006-02-02 | — | — | WO | disclosed |