Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMAD3 | P84022 | 3/20 | 0.50 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.49 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.49 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.49 |
| ▸ | PSEN1 | P49768 | 1/20 | 0.49 |
| ▸ | PSEN2 | P49810 | 1/20 | 0.49 |
| ▸ | APH1B | Q8WW43 | 1/20 | 0.49 |
| ▸ | NCSTN | Q92542 | 1/20 | 0.49 |
| ▸ | APH1A | Q96BI3 | 1/20 | 0.49 |
| ▸ | PSENEN | Q9NZ42 | 1/20 | 0.49 |
| ▸ | P4HB | P07237 | 10/20 | 0.49 |
| ▸ | MAPT | P10636 | 3/20 | 0.48 |
| ▸ | MEN1 | O00255 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.45 |
| ▸ | TSHR | P16473 | 1/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.45 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.45 |
| ▸ | KDM4D | Q6B0I6 | 1/20 | 0.41 |
| ▸ | MGAM | O43451 | 1/20 | 0.38 |
| ▸ | ACHE | P22303 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL2844085 | 0.82 | SMAD3 (0.44) | SMAD3KCNH2PTGS1PTGS2PSEN1 | |
| SCHEMBL2850061 | 0.77 | KCNH2 (0.55) | SMAD3KCNH2PTGS1PTGS2PSEN1 | |
| SCHEMBL16225988 | 0.76 | ACHE (0.51) | KCNH2PTGS1PTGS2PSEN1PSEN2 | |
| SCHEMBL2849965 | 0.73 | KDM4D (0.45) | SMAD3KCNH2PTGS1PTGS2PSEN1 | |
| SCHEMBL2852626 | 0.73 | KCNH2 (0.50) | SMAD3KCNH2PTGS1PTGS2PSEN1 | |
| SCHEMBL2842842 | 0.71 | P4HB (0.54) | SMAD3P4HBALDH1A1 | |
| SCHEMBL23293529 | 0.70 | P4HB (0.57) | SMAD3P4HBMEN1KMT2A | |
| SCHEMBL30422205 | 0.70 | P4HB (0.57) | SMAD3P4HBMEN1KMT2A | |
| SCHEMBL2844075 | 0.69 | KCNH2 (0.58) | KCNH2PTGS1PTGS2PSEN1PSEN2 | |
| SCHEMBL2848825 | 0.67 | KCNH2 (0.53) | SMAD3KCNH2PTGS1PTGS2PSEN1 |
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-2010138901-A1 | CARBOXYLIC ACID-CONTAINING COMPOUNDS, DERIVATIVES THEREOF, AND RELATED METHODS OF USE | BIOGEN IDEC MA INC (US) | 2010-12-02 | — | — | WO | disclosed |