Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.58 |
| ▸ | GAA | P10253 | 1/20 | 0.49 |
| ▸ | MEN1 | O00255 | 1/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.45 |
| ▸ | PTK2 | Q05397 | 1/20 | 0.45 |
| ▸ | NPC1 | O15118 | 1/20 | 0.45 |
| ▸ | RAB9A | P51151 | 1/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.45 |
| ▸ | LRRK2 | Q5S007 | 8/20 | 0.45 |
| ▸ | STK4 | Q13043 | 2/20 | 0.45 |
| ▸ | STK3 | Q13188 | 2/20 | 0.45 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.44 |
| ▸ | PDPK1 | O15530 | 1/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.44 |
| ▸ | PAK1 | Q13153 | 1/20 | 0.44 |
| ▸ | JAK3 | P52333 | 1/20 | 0.43 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.43 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.43 |
| ▸ | ADK | P55263 | 1/20 | 0.42 |
| ▸ | KDM5A | P29375 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL30775415 | 1.00 | KDM4E (0.58) | KDM4EGAAMEN1KMT2APTK2 | |
| SCHEMBL30775228 | 0.83 | TP53 (0.40) | KDM4EGAAMEN1KMT2ANPC1 | |
| SCHEMBL30775322 | 0.81 | TP53 (0.42) | KDM4EMEN1KMT2ANPC1RAB9A | |
| SCHEMBL10435174 | 0.80 | CYP2D6 (0.39) | KDM4EGAAMEN1KMT2ASMN1; SMN2 | |
| SCHEMBL30775194 | 0.79 | SMN1; SMN2 (0.57) | MEN1KMT2ASMN1; SMN2MAPK1 | |
| SCHEMBL30775287 | 0.79 | HSD17B10 (0.42) | KDM4EGAAMEN1KMT2ASMN1; SMN2 | |
| SCHEMBL16646727 | 0.79 | MEN1 (0.49) | KDM4EGAAMEN1KMT2APTK2 | |
| SCHEMBL27498193 | 0.79 | MAPK1 (0.54) | KDM4EGAAMEN1KMT2APTK2 | |
| SCHEMBL16702828 | 0.79 | KDM4E (0.57) | KDM4EGAAMEN1KMT2APTK2 | |
| SCHEMBL359478 | 0.79 | KDM4E (0.49) | KDM4EGAAMEN1KMT2APTK2 |
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 |
|---|---|---|---|---|---|---|---|
| CN-103789389-B | Compounds and methods for identifying, synthesizing, optimizing and characterizing protein modulators | 杰勒德·M·豪斯 | 2017-01-04 | — | — | CN | disclosed |
| US-9222933-B2 | Compounds and method of identifying, synthesizing, optimizing and profiling protein modulators | HMI Medical Innovations, LLC (US) | 2015-12-29 | — | — | US | disclosed |