Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.57 |
| ▸ | TSHR | P16473 | 2/20 | 0.57 |
| ▸ | POLB | P06746 | 1/20 | 0.57 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.57 |
| ▸ | ALDH1A1 | P00352 | 8/20 | 0.56 |
| ▸ | TDP1 | Q9NUW8 | 4/20 | 0.56 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.56 |
| ▸ | GAA | P10253 | 1/20 | 0.55 |
| ▸ | LMNA | P02545 | 2/20 | 0.54 |
| ▸ | CYP2A13 | Q16696 | 1/20 | 0.53 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.50 |
| ▸ | ACHE | P22303 | 1/20 | 0.44 |
| ▸ | CACNA1G | O43497 | 3/20 | 0.43 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.43 |
| ▸ | NPC1 | O15118 | 1/20 | 0.42 |
| ▸ | RAB9A | P51151 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL15081939 | 1.00 | KDM4E (0.57) | KDM4ETSHRPOLBSMN1; SMN2ALDH1A1 | |
| SCHEMBL807576 | 0.92 | ALDH1A1 (0.59) | KDM4ETSHRPOLBSMN1; SMN2ALDH1A1 | |
| SCHEMBL15081941 | 0.90 | KDM4E (0.45) | KDM4ETSHRPOLBSMN1; SMN2ALDH1A1 | |
| SCHEMBL10210995 | 0.90 | KDM4E (0.45) | KDM4ETSHRPOLBSMN1; SMN2ALDH1A1 | |
| SCHEMBL15081947 | 0.83 | TACR1 (0.51) | KDM4ETSHRPOLBSMN1; SMN2ALDH1A1 | |
| SCHEMBL18360638 | 0.82 | KDM4E (0.57) | KDM4ETSHRPOLBSMN1; SMN2ALDH1A1 | |
| SCHEMBL15081957 | 0.82 | KAT2B (0.50) | KDM4ETSHRPOLBSMN1; SMN2ALDH1A1 | |
| SCHEMBL19844794 | 0.82 | KAT2B (0.50) | KDM4ETSHRPOLBSMN1; SMN2ALDH1A1 | |
| SCHEMBL19368214 | 0.82 | KAT2B (0.50) | KDM4ETSHRPOLBSMN1; SMN2ALDH1A1 | |
| SCHEMBL807398 | 0.82 | CYP2A13 (0.48) | KDM4ETSHRPOLBSMN1; SMN2ALDH1A1 |
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-2012036997-A1 | FUSED PYRAZOLE DERIVATIVES AS NOVEL ERK INHIBITORS | SCHERING CORPORATION (US) | 2012-03-22 | — | — | WO | disclosed |