Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRM2 | P08172 | 1/20 | 0.36 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.36 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | GPR119 | Q8TDV5 | 3/20 | 0.35 |
| ▸ | USP2 | O75604 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | RECQL | P46063 | 1/20 | 0.35 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | THRB | P10828 | 1/20 | 0.35 |
| ▸ | PTPN2 | P17706 | 1/20 | 0.35 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.35 |
| ▸ | PTPN6 | P29350 | 1/20 | 0.35 |
| ▸ | KDM1A | O60341 | 1/20 | 0.34 |
| ▸ | PDE4A | P27815 | 1/20 | 0.34 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL24622087 | 1.00 | CHRM2 (0.36) | CHRM2CHRM1CHRM3HPGDALDH1A1 | |
| SCHEMBL21996524 | 0.80 | HPGD (0.40) | CHRM2CHRM1CHRM3HPGDALDH1A1 | |
| SCHEMBL22047542 | 0.80 | HPGD (0.40) | CHRM2CHRM1CHRM3HPGDALDH1A1 | |
| SCHEMBL28762092 | 0.79 | CHRM2 (0.36) | CHRM2CHRM1CHRM3HPGDALDH1A1 | |
| SCHEMBL29519627 | 0.78 | HSD17B10 (0.36) | CHRM2CHRM1CHRM3HPGDALDH1A1 | |
| SCHEMBL28735702 | 0.78 | HSD17B10 (0.36) | CHRM2CHRM1CHRM3HPGDALDH1A1 | |
| SCHEMBL24622086 | 0.77 | KLK7 (0.45) | GPR119SMN1; SMN2KDM4ETHRB | |
| SCHEMBL21996649 | 0.77 | KLK7 (0.45) | GPR119SMN1; SMN2KDM4ETHRB | |
| SCHEMBL21996499 | 0.77 | CHRM2 (0.35) | CHRM2CHRM1CHRM3HPGDALDH1A1 | |
| SCHEMBL25349844 | 0.72 | MEN1 (0.34) | CHRM2CHRM1CHRM3HPGDALDH1A1 |
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 |