Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | USP2 | O75604 | 2/20 | 0.38 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.38 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.37 |
| ▸ | ABCC1 | P33527 | 1/20 | 0.37 |
| ▸ | PTPRZ1 | P23471 | 2/20 | 0.37 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.36 |
| ▸ | IGF1R | P08069 | 2/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | JAK2 | O60674 | 2/20 | 0.35 |
| ▸ | JAK1 | P23458 | 2/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL24093309 | 0.86 | ALDH1A1 (0.44) | CHRM4MEN1KMT2AOPRM1LMNA | |
| SCHEMBL20781924 | 0.85 | USP2 (0.36) | USP2CHRM4ABCB1ABCC1PTPRZ1 | |
| SCHEMBL19567495 | 0.85 | USP2 (0.38) | USP2CHRM4ABCB1ABCC1PTPRZ1 | |
| SCHEMBL20782313 | 0.84 | CHRM4 (0.36) | USP2CHRM4ABCB1ABCC1PTPRZ1 | |
| SCHEMBL19567191 | 0.83 | KDM4E (0.54) | USP2OPRM1CYP2D6SMN1; SMN2JAK2 | |
| SCHEMBL24093457 | 0.81 | ALDH1A1 (0.44) | USP2MEN1KMT2AOPRL1ALDH1A1 | |
| SCHEMBL24093065 | 0.80 | ALDH1A1 (0.58) | CHRM4TSHRLMNAALDH1A1 | |
| SCHEMBL24093035 | 0.80 | ALDH1A1 (0.50) | USP2MEN1CYP1A2CYP2C9TSHR | |
| SCHEMBL19567217 | 0.79 | USP2 (0.59) | USP2MEN1CYP1A2CYP2C9TSHR | |
| SCHEMBL24093376 | 0.78 | OPRM1 (0.57) | MEN1CYP1A2CYP2C9TSHRKMT2A |
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-2017191098-A1 | PYRAZOLE DERIVATIVES, COMPOSITIONS AND THERAPEUTIC USE THEREOF | F. HOFFMANN-LA ROCHE AG (CH) | 2017-11-09 | — | — | WO | disclosed |