Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CENPE | Q02224 | 2/20 | 0.55 |
| ▸ | KIFC1 | Q9BW19 | 1/20 | 0.50 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.44 |
| ▸ | MEN1 | O00255 | 3/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.43 |
| ▸ | S1PR1 | P21453 | 2/20 | 0.43 |
| ▸ | HPGD | P15428 | 1/20 | 0.43 |
| ▸ | S1PR3 | Q99500 | 1/20 | 0.43 |
| ▸ | SMPD1 | P17405 | 1/20 | 0.41 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.40 |
| ▸ | HRH3 | Q9Y5N1 | 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 | |
|---|---|---|---|---|
| SCHEMBL4720085 | 0.90 | CENPE (0.54) | CENPEKMT2AMEN1HPGDROCK2 | |
| SCHEMBL4718071 | 0.89 | CENPE (0.49) | CENPEKMT2AMEN1CYP1A2CYP2C9 | |
| SCHEMBL4720774 | 0.88 | CENPE (0.47) | CENPEKIFC1KMT2AMEN1ALDH1A1 | |
| SCHEMBL4720907 | 0.85 | TRPM8 (0.50) | CENPECYP3A4KMT2AMEN1CYP1A2 | |
| SCHEMBL4720148 | 0.84 | PTGES (0.52) | CENPEKMT2AMEN1SMPD1 | |
| SCHEMBL4717868 | 0.84 | HDAC3 (0.46) | CENPE | |
| SCHEMBL2103268 | 0.82 | CENPE (0.56) | CENPEKIFC1CYP3A4KMT2AMEN1 | |
| SCHEMBL2104964 | 0.81 | CENPE (0.53) | CENPEKIFC1CYP3A4KMT2AMEN1 | |
| SCHEMBL2101902 | 0.81 | CENPE (0.51) | CENPEKIFC1CYP3A4KMT2AMEN1 | |
| SCHEMBL5569249 | 0.79 | CENPE (0.48) | CENPEKIFC1KMT2AMEN1S1PR1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1951719-A2 | CERTAIN CHEMICAL ENTITIES, COMPOSITIONS, AND METHODS | Cytokinetics, Inc. (US) | 2008-08-06 | — | — | EP | disclosed |
| WO-2007056469-A2 | CERTAIN CHEMICAL ENTITIES, COMPOSITIONS, AND METHODS | CYTOKINETICS, INC. (US) | 2007-05-18 | — | — | WO | disclosed |