Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTPN1 | P18031 | 2/20 | 0.39 |
| ▸ | PTPRC | P08575 | 1/20 | 0.39 |
| ▸ | PTPRF | P10586 | 1/20 | 0.39 |
| ▸ | CDC25B | P30305 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | HPGD | P15428 | 2/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.32 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.31 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.31 |
| ▸ | OPRL1 | P41146 | 1/20 | 0.31 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.31 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.31 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.31 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.31 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 1/20 | 0.30 |
| ▸ | PKM | P14618 | 1/20 | 0.30 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL9378767 | 0.83 | PTPN1 (0.35) | PTPN1PTPRCPTPRFCDC25BALDH1A1 | |
| SCHEMBL16339665 | 0.65 | PTPN1 (0.46) | PTPN1PTPRCPTPRFCDC25BALDH1A1 | |
| SCHEMBL28531443 | 0.61 | GPR3 (0.48) | CDC25BALDH1A1HPGDGAAMAPT | |
| SCHEMBL4476575 | 0.58 | PTGS2 (0.56) | PTPN1PTPRCPTPRFCDC25BPTGS2 | |
| SCHEMBL21496069 | 0.58 | MEN1 (0.50) | PTPN1PTPRCPTPRFCDC25BALDH1A1 | |
| SCHEMBL8109274 | 0.57 | ADRA2C (0.50) | ALDH1A1OPRM1OPRK1CHRM2CHRM4 | |
| SCHEMBL15551111 | 0.57 | PTPN1 (0.53) | PTPN1PTPRCPTPRFCDC25BALDH1A1 | |
| Phosphine SCHEMBL2085257 | 0.57 | PTGS2 (0.54) | PTPN1PTPRCPTPRFCDC25BPTGS2 | |
| SCHEMBL928648 | 0.56 | CDC25B (0.75) | PTPN1PTPRCPTPRFCDC25BALDH1A1 | |
| SCHEMBL219184 | 0.56 | PTPN1 (0.40) | PTPN1PTPRCPTPRFCDC25BALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0387618-A1 | 1,7-Fused 1H-indole-2-carboxylic N-(1,4-benzodiazepin-3-yl)-amides | Kali-Chemie Pharma GmbH (DE) | 1990-09-19 | — | — | EP | disclosed |