Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDR | P35968 | 8/20 | 0.42 |
| ▸ | BRAF | P15056 | 6/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.38 |
| ▸ | PTGER1 | P34995 | 1/20 | 0.38 |
| ▸ | F10 | P00742 | 1/20 | 0.37 |
| ▸ | MRGPRX4 | Q96LA9 | 2/20 | 0.37 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.36 |
| ▸ | NR4A2 | P43354 | 1/20 | 0.36 |
| ▸ | PIM1 | P11309 | 1/20 | 0.36 |
| ▸ | PDGFRA | P16234 | 1/20 | 0.36 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.36 |
| ▸ | S1PR5 | Q9H228 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL1826609 | 0.86 | KDM4E (0.49) | KDRBRAFKMT2AMEN1TSHR | |
| SCHEMBL1826827 | 0.83 | KDM4E (0.50) | KDRBRAFKMT2AMEN1TSHR | |
| SCHEMBL1822929 | 0.83 | KDM4E (0.52) | KMT2AMEN1KDM4EHSD17B10F10 | |
| SCHEMBL1823741 | 0.83 | KMT2A (0.58) | KDRBRAFKMT2AKDM4EHSD17B10 | |
| SCHEMBL1823309 | 0.83 | KDM4E (0.52) | KMT2AMEN1KDM4EHSD17B10PTGER1 | |
| SCHEMBL1824677 | 0.82 | KDM4E (0.52) | KMT2AMEN1KDM4EHSD17B10NR4A2 | |
| SCHEMBL4448039 | 0.80 | KDM4E (0.41) | KDRBRAFKMT2AMEN1TSHR | |
| SCHEMBL1827202 | 0.80 | KDM4E (0.54) | KMT2AKDM4EHSD17B10PTGER1F10 | |
| SCHEMBL1825586 | 0.80 | NR4A2 (0.55) | KMT2AMEN1KDM4EHSD17B10NR4A2 | |
| SCHEMBL1824122 | 0.79 | KDM4E (0.49) | KDRBRAFKMT2AMEN1TSHR |
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-2118051-A1 | NEW COMPOUNDS, METHODS FOR THEIR PREPARATION AND USE THEREOF | Chelsea Therapeutics, Inc. (US) | 2009-11-18 | — | — | EP | claimed |
| WO-2008097180-A1 | NEW COMPOUNDS, METHODS FOR THEIR PREPARATION AND USE THEREOF | CHELSEA THERAPEUTICS, INC. (US) | 2008-08-14 | — | — | WO | claimed |