Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PGK1 | P00558 | 7/20 | 0.50 |
| ▸ | PGK2 | P07205 | 7/20 | 0.50 |
| ▸ | PTPN1 | P18031 | 2/20 | 0.46 |
| ▸ | PTPRC | P08575 | 1/20 | 0.44 |
| ▸ | PTPN2 | P17706 | 1/20 | 0.44 |
| ▸ | PTPRB | P23467 | 1/20 | 0.44 |
| ▸ | PTPN6 | P29350 | 1/20 | 0.44 |
| ▸ | CDC25A | P30304 | 1/20 | 0.44 |
| ▸ | PTPN11 | Q06124 | 1/20 | 0.44 |
| ▸ | ENPP2 | Q13822 | 1/20 | 0.43 |
| ▸ | THRA | P10827 | 1/20 | 0.39 |
| ▸ | THRB | P10828 | 1/20 | 0.39 |
| ▸ | ACP3 | P15309 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | ENPP1 | P22413 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL16301967 | 0.81 | NQO1 (0.54) | PGK1PGK2PTPN1ENPP2SMN1; SMN2 | |
| SCHEMBL27844542 | 0.81 | PGK1 (0.47) | PGK1PGK2PTPN1PTPRCPTPN2 | |
| SCHEMBL915259 | 0.79 | ALDH1A1 (0.48) | PGK1PGK2PTPN1PTPRCPTPN2 | |
| SCHEMBL1617420 | 0.78 | PGK1 (0.67) | PGK1PGK2PTPRBENPP2ACP3 | |
| SCHEMBL915764 | 0.78 | ENPP2 (0.45) | PGK1PGK2PTPN1ENPP2 | |
| SCHEMBL2641869 | 0.78 | ENPP2 (0.45) | PGK1PGK2PTPN1PTPRCPTPN2 | |
| SCHEMBL4439201 | 0.78 | PTPN1 (0.56) | PGK1PGK2PTPN1PTPRCPTPN2 | |
| SCHEMBL4447157 | 0.78 | PGK1 (0.44) | PGK1PGK2PTPN1PTPRCPTPN2 | |
| SCHEMBL7982629 | 0.78 | ALOX15 (0.55) | PTPN1SMN1; SMN2 | |
| SCHEMBL916009 | 0.77 | ALDH1A1 (0.46) | PGK1PGK2PTPN1ENPP2THRA |
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 |
|---|---|---|---|---|---|---|---|
| EP-1041064-A2 | N-substituted alpha aminoacid amides as calcium channel modulators | ELI LILLY AND COMPANY LIMITED (GB) | 2000-10-04 | — | — | EP | disclosed |
| EP-0805147-A1 | Novel N-substituted alpha aminoacid amides as calcium channel modulators | LILLY INDUSTRIES LIMITED (GB) | 1997-11-05 | — | — | EP | disclosed |