Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PIP5K1C | O60331 | 1/20 | 0.48 |
| ▸ | ITK | Q08881 | 8/20 | 0.45 |
| ▸ | CCKAR | P32238 | 1/20 | 0.43 |
| ▸ | SYK | P43405 | 2/20 | 0.43 |
| ▸ | RIPK1 | Q13546 | 1/20 | 0.42 |
| ▸ | MAOA | P21397 | 1/20 | 0.41 |
| ▸ | MAOB | P27338 | 1/20 | 0.41 |
| ▸ | TAS1R3 | Q7RTX0 | 1/20 | 0.41 |
| ▸ | TAS1R1 | Q7RTX1 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | TP53 | P04637 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | DRD2 | P14416 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL22258787 | 0.88 | ITK (0.46) | PIP5K1CITKSYKKDM4E | |
| SCHEMBL22258963 | 0.82 | DRD2 (0.49) | ITKSYKRIPK1KDM4EDRD2 | |
| SCHEMBL6487335 | 0.82 | ITK (0.49) | ITKKDM4E | |
| SCHEMBL5759131 | 0.81 | ITK (0.48) | ITKSYK | |
| SCHEMBL5754644 | 0.78 | KDM4E (0.47) | ITKKDM4ELMNA | |
| SCHEMBL15662057 | 0.78 | KDM4E (0.54) | KDM4ELMNATP53 | |
| SCHEMBL5755157 | 0.77 | DCAF1 (0.45) | PIP5K1CITKCCKARRIPK1 | |
| SCHEMBL1440740 | 0.75 | SMYD3 (0.57) | CCKARMAOAMAOBTAS1R3TAS1R1 | |
| SCHEMBL13753384 | 0.73 | DRD2 (0.68) | CCKARTAS1R3TAS1R1KDM4ELMNA | |
| SCHEMBL29949076 | 0.73 | DRD2 (0.68) | CCKARTAS1R3TAS1R1KDM4ELMNA |
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 |
|---|---|---|---|---|---|---|---|
| WO-2020150545-A1 | PYRAZOLE DERIVATIVES AS MODULATORS OF THE WNT/B-CATENIN SIGNALING PATHWAY | SAMUMED, LLC (US) | 2020-07-23 | — | — | WO | disclosed |