Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.47 |
| ▸ | BCHE | P06276 | 3/20 | 0.45 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.41 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.40 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.40 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.40 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.40 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.40 |
| ▸ | NCOR2 | Q9Y618 | 1/20 | 0.40 |
| ▸ | ACHE | P22303 | 2/20 | 0.40 |
| ▸ | HTR6 | P50406 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL15084333 | 0.84 | HTR7 (0.51) | ALDH1A1MEN1KMT2APOLBTSHR | |
| SCHEMBL15081962 | 0.82 | OPRL1 (0.48) | ALDH1A1MEN1KMT2AHDAC8HDAC6 | |
| SCHEMBL12073915 | 0.80 | HDAC8 (0.51) | MEN1KMT2AHDAC8HDAC6POLB | |
| SCHEMBL807391 | 0.72 | CHRNA7 (0.60) | HDAC8HDAC6SMN1; SMN2TSHR | |
| SCHEMBL12301581 | 0.72 | CREBBP (0.52) | ALDH1A1MEN1KMT2APOLBSMN1; SMN2 | |
| SCHEMBL12513821 | 0.71 | CYP2D6 (0.59) | ALDH1A1BCHEMEN1KMT2APOLB | |
| SCHEMBL10212322 | 0.71 | CYP2D6 (0.59) | ALDH1A1BCHEMEN1KMT2APOLB | |
| SCHEMBL807390 | 0.68 | FAAH (0.44) | — | |
| SCHEMBL12479944 | 0.67 | CFD (0.60) | ALDH1A1KMT2APOLBSMN1; SMN2 | |
| SCHEMBL13837069 | 0.67 | CFD (0.60) | ALDH1A1KMT2APOLBSMN1; SMN2 |
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 |