Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE2A | O00408 | 1/20 | 0.42 |
| ▸ | P2RX1 | P51575 | 2/20 | 0.39 |
| ▸ | P2RX4 | Q99571 | 2/20 | 0.39 |
| ▸ | P2RX7 | Q99572 | 2/20 | 0.39 |
| ▸ | TMPRSS4 | Q9NRS4 | 2/20 | 0.39 |
| ▸ | MTOR | P42345 | 1/20 | 0.38 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.38 |
| ▸ | UTS2R | Q9UKP6 | 2/20 | 0.37 |
| ▸ | CNR2 | P34972 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 2/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.37 |
| ▸ | HTT | P42858 | 1/20 | 0.37 |
| ▸ | KCNJ5 | P48544 | 1/20 | 0.37 |
| ▸ | KCNJ3 | P48549 | 1/20 | 0.37 |
| ▸ | BAZ1A | Q9NRL2 | 1/20 | 0.36 |
| ▸ | JAK2 | O60674 | 1/20 | 0.36 |
| ▸ | JAK1 | P23458 | 1/20 | 0.36 |
| ▸ | TYK2 | P29597 | 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 | |
|---|---|---|---|---|
| SCHEMBL4355433 | 0.88 | TSHR (0.43) | EPHX2LMNASMN1; SMN2HTT | |
| SCHEMBL4359460 | 0.88 | EPHX2 (0.46) | P2RX1P2RX4P2RX7TMPRSS4MTOR | |
| SCHEMBL4354101 | 0.85 | SMN1; SMN2 (0.39) | MTORLMNASMN1; SMN2HTT | |
| SCHEMBL4354911 | 0.85 | PDE2A (0.40) | PDE2AMTOREPHX2 | |
| SCHEMBL4341759 | 0.83 | P2RX1 (0.41) | PDE2AP2RX1P2RX4P2RX7TMPRSS4 | |
| SCHEMBL4354080 | 0.82 | ALDH1A1 (0.36) | P2RX1P2RX4P2RX7TMPRSS4SMN1; SMN2 | |
| SCHEMBL4349857 | 0.81 | POLB (0.41) | SMN1; SMN2TRPV1HTT | |
| SCHEMBL4346902 | 0.80 | EPHX2 (0.54) | PDE2AP2RX1P2RX4P2RX7TMPRSS4 | |
| SCHEMBL4341321 | 0.78 | P2RX1 (0.50) | P2RX1P2RX4P2RX7TMPRSS4MTOR | |
| SCHEMBL4358931 | 0.78 | EPHX2 (0.49) | P2RX1P2RX4P2RX7TMPRSS4MTOR |
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-2100876-A2 | New compounds for the inhibition of rotamases and use thereof | Jerini AG (DE) | 2009-09-16 | — | — | EP | claimed |
| EP-2100876-A2 | New compounds for the inhibition of rotamases and use thereof | Jerini AG (DE) | 2009-09-16 | — | — | EP | disclosed |