Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM1A | O60341 | 1/20 | 0.39 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.38 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.38 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.38 |
| ▸ | PDE4A | P27815 | 1/20 | 0.38 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.38 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.38 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | GPR119 | Q8TDV5 | 4/20 | 0.37 |
| ▸ | USP2 | O75604 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | RECQL | P46063 | 1/20 | 0.36 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | THRB | P10828 | 1/20 | 0.36 |
| ▸ | PTPN2 | P17706 | 1/20 | 0.36 |
| ▸ | PTPN1 | P18031 | 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 | |
|---|---|---|---|---|
| SCHEMBL22323578 | 0.81 | KDM1A (0.39) | KDM1ACHRM2CHRM1CHRM3PDE4A | |
| SCHEMBL21996474 | 0.81 | KDM1A (0.39) | KDM1ACHRM2CHRM1CHRM3PDE4A | |
| SCHEMBL22323738 | 0.76 | KLK7 (0.46) | KDM1AGPR119SMN1; SMN2KDM4ETHRB | |
| SCHEMBL31506527 | 0.75 | PDE4A (0.44) | CHRM2CHRM1CHRM3PDE4APDE4B | |
| SCHEMBL136257 | 0.73 | NR1H2 (0.41) | PDE4BHPGDALDH1A1GPR119USP2 | |
| SCHEMBL26967939 | 0.73 | PDE4A (0.45) | KDM1ACHRM2CHRM1CHRM3PDE4A | |
| SCHEMBL22059602 | 0.73 | CHRM2 (0.44) | KDM1ACHRM2CHRM1CHRM3PDE4A | |
| SCHEMBL2770672 | 0.73 | SMN1; SMN2 (0.42) | HPGDALDH1A1SMN1; SMN2RECQLEPHX1 | |
| SCHEMBL18479382 | 0.72 | KDM4E (0.37) | KDM1ACHRM2CHRM1CHRM3HPGD | |
| SCHEMBL26967961 | 0.71 | PDE4B (0.51) | KDM1ACHRM2CHRM1CHRM3PDE4A |
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 |
|---|---|---|---|---|---|---|---|
| WO-2020113077-A9 | COMPOSITIONS AND METHODS FOR MODULAR CONTROL OF BIOORTHOGONAL LIGATION | THE RESEARCH FOUNDATION FOR THE STATE UNIVERSITY OF NEW YORK (US) | 2020-08-13 | — | — | WO | disclosed |
| WO-2020113077-A1 | COMPOSITIONS AND METHODS FOR MODULAR CONTROL OF BIOORTHOGONAL LIGATION | THE RESEARCH FOUNDATION FOR THE STATE UNIVERSITY OF NEW YORK (US) | 2020-06-04 | — | — | WO | disclosed |