Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 4/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.50 |
| ▸ | MAPT | P10636 | 4/20 | 0.50 |
| ▸ | HPGD | P15428 | 2/20 | 0.50 |
| ▸ | GAA | P10253 | 1/20 | 0.50 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.45 |
| ▸ | SMPD1 | P17405 | 2/20 | 0.43 |
| ▸ | KCNB1 | Q14721 | 1/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.40 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.40 |
| ▸ | DRD3 | P35462 | 1/20 | 0.40 |
| ▸ | SLC5A1 | P13866 | 1/20 | 0.39 |
| ▸ | SLC5A2 | P31639 | 1/20 | 0.39 |
| ▸ | SENP8 | Q96LD8 | 1/20 | 0.38 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.38 |
| ▸ | SENP6 | Q9GZR1 | 1/20 | 0.38 |
| ▸ | SYNJ2 | O15056 | 1/20 | 0.37 |
| ▸ | IMPDH2 | P12268 | 1/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.37 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL3860745 | 0.77 | CYP3A4 (0.42) | MAPTHPGDCYP3A4IMPDH2TDP1 | |
| SCHEMBL15266045 | 0.76 | ALOX5 (0.44) | IMPDH2 | |
| SCHEMBL743276 | 0.71 | ERN1 (0.57) | KMT2AMAPTCYP3A4MAPK1 | |
| SCHEMBL16166121 | 0.68 | ABCB1 (0.46) | MAPTGAACYP3A4PTGS1TDP1 | |
| SCHEMBL742431 | 0.68 | SLC28A3 (0.38) | MEN1KMT2AHPGDCYP19A1SMPD1 | |
| SCHEMBL1245802 | 0.67 | GAA (0.83) | MEN1KMT2AMAPTHPGDGAA | |
| SCHEMBL3965268 | 0.67 | GAA (0.83) | MEN1KMT2AMAPTHPGDGAA | |
| SCHEMBL29535946 | 0.67 | GAA (0.83) | MEN1KMT2AMAPTHPGDGAA | |
| Water SCHEMBL6998437 | 0.66 | SLC28A3 (0.36) | MEN1KMT2AHPGDCYP19A1SMPD1 | |
| SCHEMBL7187209 | 0.66 | CYP19A1 (0.68) | MEN1KMT2AMAPTHPGDGAA |
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 |
|---|---|---|---|---|---|---|---|
| EP-2429292-A1 | COMPOUNDS AND COMPOSITIONS COMPRISING CDK INHIBITORS AND METHODS FOR THE TREATMENT OF CANCER | Georgia State University Research Foundation, Inc. (US) | 2012-03-21 | — | — | EP | disclosed |