Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.49 |
| ▸ | LMNA | P02545 | 3/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.48 |
| ▸ | MAPT | P10636 | 2/20 | 0.47 |
| ▸ | GAA | P10253 | 1/20 | 0.47 |
| ▸ | HPGD | P15428 | 1/20 | 0.47 |
| ▸ | MEN1 | O00255 | 1/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.46 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.46 |
| ▸ | CHKA | P35790 | 1/20 | 0.45 |
| ▸ | TNF | P01375 | 1/20 | 0.45 |
| ▸ | GLA | P06280 | 1/20 | 0.44 |
| ▸ | ATM | Q13315 | 1/20 | 0.44 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.44 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL2120501 | 0.93 | ALDH1A1 (0.49) | ALDH1A1KDM4ELMNAKMT2AMAPT | |
| SCHEMBL2120504 | 0.93 | ALDH1A1 (0.49) | ALDH1A1KDM4ELMNAKMT2AMAPT | |
| SCHEMBL7234781 | 0.91 | KDM4E (0.51) | ALDH1A1KDM4ELMNAKMT2AGAA | |
| SCHEMBL7982079 | 0.89 | ALDH1A1 (0.51) | ALDH1A1KDM4ELMNAKMT2AMAPT | |
| SCHEMBL17976195 | 0.89 | LMNA (0.47) | ALDH1A1KDM4ELMNAKMT2AMAPT | |
| SCHEMBL17976178 | 0.88 | LMNA (0.46) | ALDH1A1KDM4ELMNAKMT2AMAPT | |
| SCHEMBL3161761 | 0.88 | KMT2A (0.52) | ALDH1A1LMNAKMT2AMAPTGAA | |
| SCHEMBL3161752 | 0.88 | KMT2A (0.52) | ALDH1A1LMNAKMT2AMAPTGAA | |
| SCHEMBL17976228 | 0.88 | LMNA (0.46) | ALDH1A1KDM4ELMNAKMT2AMAPT | |
| SCHEMBL17976485 | 0.88 | LMNA (0.44) | ALDH1A1KDM4ELMNAKMT2AMAPT |
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 |
|---|---|---|---|---|---|---|---|
| US-6545035-B1 | Having effect on various kinases and cycline/CDK complexes and on the proliferation of various tumour cells. | BOEHRINGER INGELHEIM PHARMA KG (DE) | 2003-04-08 | — | — | US | disclosed |