Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DGAT1 | O75907 | 1/20 | 0.40 |
| ▸ | TMEM97 | Q5BJF2 | 1/20 | 0.36 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.34 |
| ▸ | POLB | P06746 | 3/20 | 0.34 |
| ▸ | NPC1 | O15118 | 3/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.34 |
| ▸ | RAB9A | P51151 | 2/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.34 |
| ▸ | USP30 | Q70CQ3 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | CTSL | P07711 | 2/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL5708704 | 0.74 | KMT2A (0.36) | ALDH1A1POLBKMT2ASMN1; SMN2 | |
| SCHEMBL29549083 | 0.74 | CTSL (0.42) | DGAT1ALDH1A1POLBNPC1KMT2A | |
| SCHEMBL4217279 | 0.74 | CTSL (0.48) | DGAT1ALDH1A1POLBNPC1KMT2A | |
| SCHEMBL4219563 | 0.74 | CTSL (0.48) | DGAT1ALDH1A1POLBNPC1KMT2A | |
| SCHEMBL22804883 | 0.73 | DGAT1 (0.46) | DGAT1ALDH1A1POLBNPC1KMT2A | |
| SCHEMBL22804884 | 0.73 | DGAT1 (0.46) | DGAT1ALDH1A1POLBNPC1KMT2A | |
| SCHEMBL13969781 | 0.72 | NPC1 (0.44) | DGAT1POLBNPC1KMT2ARAB9A | |
| SCHEMBL13948872 | 0.72 | NPC1 (0.44) | DGAT1POLBNPC1KMT2ARAB9A | |
| SCHEMBL4214280 | 0.70 | DGAT1 (0.58) | DGAT1ALDH1A1POLBNPC1KMT2A | |
| SCHEMBL5707140 | 0.68 | BMP1 (0.43) | DGAT1TMEM97SIGMAR1ALDH1A1NPC1 |
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-1708996-A1 | FUSED HETEROYRAL DERIVATIVES FOR USE AS P38 KINASE INHIBITORS | SMITHKLINE BEECHAM CORPORATION (US) | 2006-10-11 | — | — | EP | disclosed |
| WO-2005073189-A1 | FUSED HETEROYRAL DERIVATIVES FOR USE AS P38 KINASE INHIBITORS | SMITHKLINE BEECHAM CORPORATION (US) | 2005-08-11 | — | — | WO | disclosed |