Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 11/20 | 0.56 |
| ▸ | MEN1 | O00255 | 3/20 | 0.52 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.52 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.52 |
| ▸ | RAB9A | P51151 | 1/20 | 0.52 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.49 |
| ▸ | THRB | P10828 | 2/20 | 0.48 |
| ▸ | LMNA | P02545 | 2/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.48 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.48 |
| ▸ | TP53 | P04637 | 4/20 | 0.47 |
| ▸ | RXFP1 | Q9HBX9 | 3/20 | 0.46 |
| ▸ | POLB | P06746 | 2/20 | 0.46 |
| ▸ | CTSD | P07339 | 1/20 | 0.46 |
| ▸ | GAA | P10253 | 2/20 | 0.45 |
| ▸ | AGPAT2 | O15120 | 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 | |
|---|---|---|---|---|
| SCHEMBL4341725 | 0.88 | MAPT (0.52) | MAPTMEN1KMT2AKDM4ERAB9A | |
| SCHEMBL4341723 | 0.87 | MAPT (0.49) | MAPTMEN1KMT2AKDM4ERAB9A | |
| SCHEMBL4561504 | 0.84 | MAPT (0.54) | MAPTMEN1KMT2AKDM4ERAB9A | |
| SCHEMBL4354538 | 0.83 | SMN1; SMN2 (0.52) | MAPTMEN1KMT2AKDM4ERAB9A | |
| SCHEMBL4344552 | 0.82 | NAMPT (0.57) | MAPTMEN1KMT2AKDM4ERAB9A | |
| SCHEMBL6526530 | 0.81 | MAPT (0.51) | MAPTMEN1KMT2AKDM4ERAB9A | |
| SCHEMBL4347124 | 0.80 | EPHX2 (0.48) | MAPTMEN1KMT2AKDM4ERAB9A | |
| SCHEMBL4355895 | 0.80 | RAB9A (0.58) | MAPTMEN1KMT2AKDM4ERAB9A | |
| SCHEMBL6224490 | 0.80 | MAPT (0.44) | MAPTMEN1KMT2AKDM4ERAB9A | |
| SCHEMBL12846511 | 0.80 | SMN1; SMN2 (0.49) | MAPTMEN1KMT2AKDM4ERAB9A |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2100876-A2 | New compounds for the inhibition of rotamases and use thereof | Jerini AG (DE) | 2009-09-16 | — | — | EP | claimed |
| CN-1701061-A | Novel compounds for inhibiting rotamase enzymes and uses thereof | JERINI AG (DE) | 2005-11-23 | — | — | CN | claimed |
| EP-2100876-A2 | New compounds for the inhibition of rotamases and use thereof | Jerini AG (DE) | 2009-09-16 | — | — | EP | disclosed |