Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 4/20 | 0.43 |
| ▸ | MEN1 | O00255 | 3/20 | 0.43 |
| ▸ | DGAT1 | O75907 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.40 |
| ▸ | HTT | P42858 | 3/20 | 0.40 |
| ▸ | MAPT | P10636 | 3/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.40 |
| ▸ | LMNA | P02545 | 2/20 | 0.40 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.39 |
| ▸ | CNR1 | P21554 | 3/20 | 0.39 |
| ▸ | DRD1 | P21728 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | CASP1 | P29466 | 1/20 | 0.39 |
| ▸ | CASP7 | P55210 | 1/20 | 0.39 |
| ▸ | HBB | P68871 | 1/20 | 0.39 |
| ▸ | DCPS | Q96C86 | 2/20 | 0.37 |
| ▸ | POLB | P06746 | 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 | |
|---|---|---|---|---|
| SCHEMBL4134698 | 0.72 | KMT2A (0.47) | KMT2AMEN1DGAT1ALDH1A1HTT | |
| SCHEMBL4450457 | 0.64 | KMT2A (0.44) | KMT2AMEN1DGAT1MAPTSMN1; SMN2 | |
| SCHEMBL6979861 | 0.64 | ROCK1 (0.42) | KMT2AMEN1ALDH1A1HTTSMN1; SMN2 | |
| SCHEMBL4130631 | 0.63 | KMT2A (0.46) | KMT2AMEN1DGAT1MAPTSMN1; SMN2 | |
| SCHEMBL4130629 | 0.63 | KMT2A (0.46) | KMT2AMEN1DGAT1ALDH1A1MAPT | |
| SCHEMBL2636181 | 0.62 | RBP4 (0.49) | KMT2AMEN1 | |
| SCHEMBL27689684 | 0.62 | ADORA2A (0.54) | DCPS | |
| SCHEMBL6981163 | 0.61 | PARP1 (0.45) | ALDH1A1HTTMAPTLMNAKDM4E | |
| SCHEMBL6977139 | 0.61 | PARP1 (0.45) | ALDH1A1HTTMAPTLMNAKDM4E | |
| SCHEMBL6970712 | 0.61 | PARP1 (0.45) | ALDH1A1HTTMAPTLMNAKDM4E |
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-2134695-A1 | INHIBITORS OF THE HEDGEHOG PATHWAY | Exelixis, Inc. (US) | 2009-12-23 | — | — | EP | disclosed |
| WO-2008112913-A1 | INHIBITORS OF THE HEDGEHOG PATHWAY | EXELIXIS, INC. (US) | 2008-09-18 | — | — | WO | disclosed |