Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IKBKB | O14920 | 4/20 | 0.64 |
| ▸ | LIMK1 | P53667 | 5/20 | 0.61 |
| ▸ | HTT | P42858 | 4/20 | 0.61 |
| ▸ | MAPT | P10636 | 3/20 | 0.61 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.61 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.61 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.61 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.60 |
| ▸ | MEN1 | O00255 | 2/20 | 0.60 |
| ▸ | HPGD | P15428 | 1/20 | 0.53 |
| ▸ | LMNA | P02545 | 1/20 | 0.53 |
| ▸ | PLA2G1B | P04054 | 1/20 | 0.53 |
| ▸ | ATG4B | Q9Y4P1 | 1/20 | 0.53 |
| ▸ | CHUK | O15111 | 1/20 | 0.52 |
| ▸ | PRKACA | P17612 | 1/20 | 0.52 |
| ▸ | PRKACG | P22612 | 1/20 | 0.52 |
| ▸ | PRKACB | P22694 | 1/20 | 0.52 |
| ▸ | BTK | Q06187 | 1/20 | 0.52 |
| ▸ | NPC1 | O15118 | 2/20 | 0.52 |
| ▸ | RAB9A | P51151 | 2/20 | 0.52 |
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 | |
|---|---|---|---|---|
| SCHEMBL6219075 | 0.85 | MEN1 (0.46) | IKBKBLIMK1HTTMAPTALDH1A1 | |
| SCHEMBL4924409 | 0.85 | BRAF (0.70) | IKBKBLIMK1HTTMAPTALDH1A1 | |
| SCHEMBL6217652 | 0.84 | LIMK1 (0.58) | IKBKBLIMK1HTTMAPTALDH1A1 | |
| SCHEMBL4906159 | 0.82 | BRAF (0.79) | IKBKBLIMK1SMN1; SMN2HPGDCHUK | |
| SCHEMBL6216817 | 0.81 | ALDH1A1 (0.48) | IKBKBLIMK1HTTMAPTALDH1A1 | |
| SCHEMBL1176458 | 0.80 | IKBKB (0.68) | IKBKBLIMK1HTTMAPTALDH1A1 | |
| SCHEMBL4898970 | 0.80 | IKBKB (0.52) | IKBKBLIMK1HTTMAPTALDH1A1 | |
| SCHEMBL6216687 | 0.79 | ALDH1A1 (0.50) | IKBKBLIMK1HTTMAPTALDH1A1 | |
| SCHEMBL3320601 | 0.79 | IKBKB (0.54) | IKBKBLIMK1HTTMAPTALDH1A1 | |
| SCHEMBL6110291 | 0.79 | KMT2A (0.71) | IKBKBLIMK1HTTMAPTALDH1A1 |
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 |