Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 16/20 | 0.60 |
| ▸ | MEN1 | O00255 | 3/20 | 0.60 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.60 |
| ▸ | TSHR | P16473 | 1/20 | 0.60 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.56 |
| ▸ | HTT | P42858 | 1/20 | 0.56 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.53 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.53 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.53 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.53 |
| ▸ | ATM | Q13315 | 1/20 | 0.53 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.50 |
| ▸ | PKM | P14618 | 3/20 | 0.47 |
| ▸ | MAPT | P10636 | 2/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.42 |
| ▸ | POLB | P06746 | 1/20 | 0.42 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 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 | |
|---|---|---|---|---|
| SCHEMBL13698540 | 0.91 | KDM4E (0.67) | KDM4EMEN1KMT2ATSHRALDH1A1 | |
| SCHEMBL3977661 | 0.81 | KDM4E (0.71) | KDM4EMEN1KMT2ATSHRALDH1A1 | |
| SCHEMBL13698450 | 0.81 | KDM4E (0.62) | KDM4EMEN1KMT2ATSHRALDH1A1 | |
| SCHEMBL13698491 | 0.80 | KDM4E (0.69) | KDM4EMEN1KMT2ATSHRALDH1A1 | |
| SCHEMBL3453886 | 0.78 | KDM4E (0.58) | KDM4EMEN1KMT2ATSHRALDH1A1 | |
| SCHEMBL13698440 | 0.77 | KDM4E (0.71) | KDM4EMEN1KMT2ATSHRALDH1A1 | |
| SCHEMBL13698510 | 0.76 | KDM4E (0.56) | KDM4EMEN1KMT2ATSHRALDH1A1 | |
| SCHEMBL3453365 | 0.76 | KDM4E (0.60) | KDM4EMEN1KMT2ATSHRALDH1A1 | |
| SCHEMBL3453457 | 0.76 | KDM4E (0.60) | KDM4EMEN1KMT2ATSHRALDH1A1 | |
| SCHEMBL13698451 | 0.76 | KDM4E (0.74) | KDM4EMEN1KMT2ATSHRALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| US-7563795-B2 | Phenyl-piperazine derivatives as modulators of muscarinic receptors | VERTEX PHARMACEUTICALS INCORPORATED (US) | 2009-07-21 | — | — | US | disclosed |
| US-7563795-B2 | Phenyl-piperazine derivatives as modulators of muscarinic receptors | VERTEX PHARMACEUTICALS INCORPORATED (US) | 2009-07-21 | — | — | US | disclosed |